Crystal and mol-ecular structure of jatrophane diterpenoid (2,3,4,5,7,8,9,13,14,15)-2,3,8,9-tetra-acet-oxy-5,14-bis-(benzo-yloxy)-15-hydroxy-7-(iso-butano-yloxy)jatropha-6(17),11()-diene.

The structure of the jatrophane diterpenoid (ES2), CHO, has ortho-rhom-bic (222) symmetry. The absolute configuration in the crystal has been determined as 2,3,4,5,7,8,9,13,14,15 [the Flack parameter is -0.06 (11)].

Crystal structure of bis-p-anizidinegossypol with an unknown solvate.

The title compound, C44H44N2O8, (systematic name: 1,1',6,6'-tetra-hydroxy-5,5'-diisopropyl-8,8'-bis-{[(4-meth-oxy-phen-yl)iminium-yl]meth-yl}-3,3'-dimethyl-2,2'-bi-naphthalene-7,7'-diolate) has been obtained by the addition of p-anizidine to gossypol dissolved in di-chloro-methane. In the solid state, the title compound exists in the enamine or quinoid form. The two naphthyl moieties are inclined to one another by 72.

Mol-ecular and crystal structure of gossypol tetra-methyl ether with an unknown solvate.

The title compound, C34H38O8 (systematic name: 5,5'-diisopropyl-2,2',3,3'-tetra-meth-oxy-7,7'-dimethyl-2H,2'H-8,8'-bi-[naphtho-[1,8-bc]furan]-4,4'-diol), has been obtained from a gossypol solution in a mixture of dimethyl sulfate and methanol. The mol-ecule is situated on a twofold rotation axis, so the asymmetric unit contains one half-mol-ecule. In the mol-ecule, the hy-droxy groups are involved in intra-molecular O-H⋯O hydrogen bonds, and the two naphthyl fragments are inclined each to other by 83.

2,2'-Bis{8-[(benzyl-amino)-methyl-idene]-1,6-dihy-droxy-5-isopropyl-3-methyl-naphthalen-7(8H)-one}.

The asymmetric unit of the title compound, C44H44N2O6, contains two independent mol-ecules with similar conformations. The di-hydro-naphthalene ring systems are approximately planar [maximum deviations = 0.036 (2), 0.

Lacinilene C 7-methyl ether.

The title compound, C16H20O3 [systematic name: 1-hy-droxy-7-meth-oxy-1,6-dimethyl-4-(propan-2-yl)naphthalen-2(1H)-one], is a sesquiterpene isolated from foliar tissues of the cotton plant and is of inter-est with respect to its anti-bacterial properties. Its phenyl ring is ideally planar, and the maximum of deviation in the second ring is 0.386 (3) Å.

1,2-Ethyl-enediaminium bis-(2-benzamido-benzoate).

In the title salt, C2H10N2 (2+)·2C14H10NO3 (-), the ethyl-ene-diaminium dication lies on an inversion centre. In the anion, the benzene rings make a dihedral angle of 33.87 (9)° and intramolecular N-H⋯O and C-H⋯O hydrogen bonds occur.

trans-Tetra-aqua-bis-[2-(4-chloro-phen-oxy)acetato-κO (1)]nickel(II).

In the title compound, [Ni(C8H6ClO3)2(H2O)4], the Ni(II) ion is located on a crystallographic inversion centre and is octa-hedrally coordinated by two 2-(4-chloro-phen-oxy)acetate ligands in axial positions and by four water mol-ecules in the equatorial plane. The acetate ligands are bound to the Ni(II) ion in a monodentate manner through a carboxyl-ate O atom. In the crystal, O-H⋯O hydrogen bonds link the mol-ecules, forming a two-dimensional supra-molecular network lying parallel to the ab plane.

Desoxyhemigossypol 6-methyl ether.

THE TITLE SESQUITERPENE [SYSTEMATIC NAME: 6-methoxy-10-methyl-7-(propan-2-yl)-2-oxatricyclo[6.3.1.

2-Methyl-pyridine-urea (1/1).

In the crystal structure of the title compound, C(6)H(7)N·CH(4)N(2)O, the 2-methyl-pyridine and urea mol-ecules are linked via N-H⋯O and N-H⋯N hydrogen bonds, forming ribbons extending along the a axis. The dihedral angle between the 2-methyl-pyridine and urea mean planes is 89.09 (9)°.

Methyl 2-[(carbamoyl-amino)-imino]-2-(3-{1-[(carbamoyl-amino)-imino]-2-meth-oxy-2-oxoeth-yl}phen-yl)acetate ethanol monosolvate monohydrate.

In the title compound, C(14)H(16)N(6)O(6)·C(2)H(6)O·H(2)O, both substit-uents of the benzene ring are approximately planar with maximum deviations from the mean plane of 0.0561 (12) (an imine N atom) and 0.1419 (11) Å (a meth-oxy O atom).

{4-[(2,4-Dichloro-benzo-yloxy)meth-yl]-1-phenyl-1H-1,2,3-triazol-5-yl}methyl 2,4-dichloro-benzoate.

In the title molecule, C(24)H(15)Cl(4)N(3)O(4), the triazole ring makes dihedral angles of 72.02 (12), 81.60 (12) and 73.

1-(5-Acetyl-2-hy-droxy-phen-yl)ethanone.

The crystal structure of the title compound, C(10)H(10)O(3), is characterized by classical intra-molecular hydrogen bonding. The hy-droxy group is disordered over two positions (77 and 23%). The crystal structure is stabilized via π-π [3.

2-{2-[2-(1,3-Dioxoisoindol-2-yl)eth-oxy]eth-yl}isoindole-1,3-dione.

In the mol-ecule of the title compound, C(20)H(16)N(2)O(5), the phthalimide fragments are almost planar, with r.m.s.

S,S'-(Pyridazine-3,6-di-yl)dithio-uronium dichloride methanol monosolvate.

In the title compound, C(6)H(10)N(6)S(2) (2+)·2Cl(-)·CH(3)OH, the pyrid-azine ring is almost planar, the greatest deviation from the mean plane being 0.025 (2) Å for one of the ring N atoms. The two thiouronium substituents are tilted out of this plane by 60.

(1-Phenyl-1H-1,2,3-triazol-4-yl)methyl pyridine-3-carboxyl-ate.

In the title compound, C(15)H(12)N(4)O(2), the dihedral angle between the planes of the nicotino-yloxy fragment and triazole ring is 88.61 (5)°. The dihedral angle between the planes of triazole and benzene rings is 16.

Bis(7-meth-oxy-1-methyl-4,9-dihydro-3H-β-carbolinium) tetra-chloridozincate.

In the title compound, (C(13)H(15)N(2)O)(2)[ZnCl(4)], also known as di(harmalinium) tetra-chloridozincate, the Zn(II) atom is in a distorted tetrahedral coordination of the chlorido ligands. In the cation, the meth-oxy and methyl groups are both coplanar with with rings to which they are attached [maximum deviations of 0.232 (4) and 0.

Redetermnation of lagochiline monohydrate.

In the title compound, C(20)H(36)O(5)·H(2)O, previously studied by film methods [Vorontsova et al. (1975 ▶). Izvest.

Bis(acetyl-acetonato-κO,O')(2-amino-1-methyl-1H-benzimidazole-κN)oxido-vanadium(IV).

The title mixed-ligand oxidovanadium(IV) compound, [VO(C(5)H(7)O(2))(2)(C(8)H(9)N(3))], contains a V(IV) atom in a distorted octahedral coordination, which is typical for such complexes. The vanadyl group and the N-heterocyclic ligand are cis to each other. The coordination bond is located at the endocyclic N atom of the benzimidazole ligand.

1,1'-Binaphthyl-2,2'-dicarboxylic acid-urea (1/1).

In the title co-crystal, C(22)H(14)O(4)·CH(4)N(2)O, the 1,1'-binaphthyl-2,2'-dicarboxylic acid (BNDA) and urea mol-ecules are connected via a system of hydrogen bonds into a chiral two-dimensional polymeric structure parallel to the (001) plane. As the crystal is centrosymmetric, it consists of alternately stacked BNDA-urea layers of opposite chirality. The urea H atoms trans to the C=O group are bonded in a chelating mode [R(1) (2)(6)] to the carbonyl O atom from one of the carboxylic acid groups which, in turn, acts as the donor of an O-H⋯O hydrogen bond to another urea mol-ecule.