Information card for entry 1549210

Structure parameters

• Formula: C30 H28 N2 Pt
• Calculated formula: C30 H28 N2 Pt
• SMILES: C(#[N]Cc1ccccc1)[Pt](C#[N]Cc1ccccc1)(c1ccc(cc1)C)c1ccc(cc1)C
• Title of publication: Synthesis, structural characterization, biological evaluation and molecular docking studies of new platinum(ii) complexes containing isocyanides
• Authors of publication: Fereidoonnezhad, Masood; Shahsavari, Hamid R.; Abedanzadeh, Sedigheh; Nezafati, Ali; Khazali, Ali; Mastrorilli, Piero; Babaghasabha, Mojgan; Webb, James; Faghih, Zeinab; Faghih, Zahra; Bahemmat, Samira; Beyzavi, M. Hassan
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 11
• Pages of publication: 8681
• a: 9.994 ± 0.002 Å
• b: 10.991 ± 0.002 Å
• c: 13.402 ± 0.003 Å
• α: 94.44 ± 0.03°
• β: 111.73 ± 0.03°
• γ: 106.35 ± 0.03°
• Cell volume: 1284.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0684
• Residual factor for significantly intense reflections: 0.0568
• Weighted residual factors for significantly intense reflections: 0.1255
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No