Information card for entry 7004424

Structure parameters

• Formula: C18 H28 N14 O14 Pt
• Calculated formula: C18 H28 N14 O14 Pt
• SMILES: C(N)(=[NH][Pt]([NH3])([NH3])[NH]=C(N)N(C)C)N(C)C.c1([O-])c(cc(cc1N(=O)=O)N(=O)=O)N(=O)=O.c1([O-])c(cc(cc1N(=O)=O)N(=O)=O)N(=O)=O
• 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: 7.1799 ± 0.0004 Å
• b: 25.9606 ± 0.0016 Å
• c: 8.3485 ± 0.001 Å
• α: 90°
• β: 114.039 ± 0.005°
• γ: 90°
• Cell volume: 1421.2 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.0254
• Weighted residual factors for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections included in the refinement: 0.0576
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No