Information card for entry 4020262

Structure parameters

• Formula: C153 H189 Cl3 N16 Zn4
• Calculated formula: C153 H189 Cl3 N16 Zn4
• SMILES: [Zn]123[N]4=C5C(=C6[N]3=C(C(=C3[N]2=C(C(=C2[N]1=C(C(=C4C=C5)C1=C4[N]5[Zn]78[N]9=C1C=CC9=C(C1=[N]7C(C=C1)=C(C1=[N]8C(C=C1)=C(C5C=C4)CCCCCC)CCCCCC)CCCCCC)C=C2)CCCCCC)C=C3)CCCCCC)C=C6)CCCCCC.ClC(Cl)Cl
• Authors of publication: Satoru Hiroto; Atsuhiro Osuka
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 4054 - 4058
• a: 17.509 ± 0.018 Å
• b: 17.694 ± 0.017 Å
• c: 23.43 ± 0.02 Å
• α: 105.17 ± 0.07°
• β: 93.96 ± 0.09°
• γ: 103.58 ± 0.09°
• Cell volume: 6745 ± 11 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No