Information card for entry 7004419

Structure parameters

• Formula: C60 H76 B2 N8 O2 Pt
• Calculated formula: C60 H76 B2 N8 O2 Pt
• SMILES: [Pt]([NH3])([NH3])([NH]=C(N)N(C)C)[NH]=C(N)N(C)C.O=C(C)C.O=C(C)C.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1.c1(ccccc1)[B-](c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Facile cyanamide‒ammonia coupling mediated by cis- and trans-[PtIIL2] centers and giving metal-bound guanidines
• Authors of publication: Tyan, Marina R.; Bokach, Nadezhda A.; Wang, Meng-Jiy; Haukka, Matti; Kuznetsov, Maxim L.; Kukushkin, Vadim Yu.
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 38
• Pages of publication: 5178 - 5188
• a: 11.1727 ± 0.0007 Å
• b: 21.6856 ± 0.0014 Å
• c: 23.505 ± 0.0016 Å
• α: 93.241 ± 0.003°
• β: 95.434 ± 0.004°
• γ: 90.226 ± 0.004°
• Cell volume: 5660 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1439
• Residual factor for significantly intense reflections: 0.0662
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No