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1-[4-(Diamino-methyl-eneamino-sulfon-yl)phenyl-iminiometh-yl]-2-naphtholate N,N-dimethyl-formamide disolvate.

ABSTRACT: The asymmetric unit the title compound, C(18)H(16)N(4)O(3)S·2C(3)H(7)NO, contains a mol-ecule in a zwitterionic form with a deprotonated hydroxyl group and an iminium group, and two dimethyl-formamide solvent mol-ecules. The dihedral angles of the guanidine group and the naphthyl ring system with respect to the central benzene ring are 76.04?(7) and 3.45?(9)°, respectively. The conformation of the mol-ecule may be influenced, in part, by two intra-molecular hydrogen bonds, while in the crystal structure, inter-molecular hydrogen bonds form one-dimensional chains along [010].

SUBMITTER: El-Ghamry H

PROVIDER: S-EPMC2961766 | biostudies-literature | 2008 Jun

REPOSITORIES: biostudies-literature

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1-[4-(Diamino-methyl-eneamino-sulfon-yl)phenyl-iminiometh-yl]-2-naphtholate N,N-dimethyl-formamide disolvate.

El-Ghamry Hoda H Issa Raafat R El-Baradie Kamal K Isagai Keiko K Masaoka Shigeyuki S Sakai Ken K

Acta crystallographica. Section E, Structure reports online 20080628 Pt 7

The asymmetric unit the title compound, C(18)H(16)N(4)O(3)S·2C(3)H(7)NO, contains a mol-ecule in a zwitterionic form with a deprotonated hydroxyl group and an iminium group, and two dimethyl-formamide solvent mol-ecules. The dihedral angles of the guanidine group and the naphthyl ring system with respect to the central benzene ring are 76.04 (7) and 3.45 (9)°, respectively. The conformation of the mol-ecule may be influenced, in part, by two intra-molecular hydrogen bonds, while in the crystal s ...[more]

PMID: 21202970

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