Information card for entry 7100329

Structure parameters

• Formula: C31 H33 B Cl2 N6 S3 Sn
• Calculated formula: C31 H33 B Cl2 N6 S3 Sn
• SMILES: [Sn]([S]=C1N([BH](N2C(=S)N(C=C2)C)N2C(=S)N(C=C2)C)C=CN1C)(c1ccccc1)(c1ccccc1)c1ccccc1.ClCCl
• Title of publication: Novel Poly(methimazolyl)borate Complexes of Niobium and Tantalum
• Authors of publication: M.K. Smith; A.F. Hill
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 9.18 ± 0.0018 Å
• b: 10.14 ± 0.002 Å
• c: 21.54 ± 0.004 Å
• α: 96.09 ± 0.03°
• β: 98.22 ± 0.03°
• γ: 114.39 ± 0.03°
• Cell volume: 1776.8 ± 0.6 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• 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