Information card for entry 7050692

Structure parameters

• Formula: C13 H10 N4 O5
• Calculated formula: C13 H10 N4 O5
• SMILES: Oc1c(C=NNc2ccc(N(=O)=O)cc2N(=O)=O)cccc1
• Title of publication: Cooperative effect of multiple hydrogen bonding involving nitro group - solid state dimeric self-assembly of o-, m-, p-hydroxyphenyl-2,4-dinitrophenylhydrazones
• Authors of publication: Urbanczyk-Lipkowska, Z.; Szczesna, B.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2002
• a: 13.767 ± 0.0004 Å
• b: 4.353 ± 0.0001 Å
• c: 21.118 ± 0.0007 Å
• α: 90°
• β: 90.407 ± 0.0012°
• γ: 90°
• Cell volume: 1265.52 ± 0.06 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No