Information card for entry 4060720

Structure parameters

• Formula: C24 H22 I2 N12 Pd2
• Calculated formula: C24 H22 I2 N12 Pd2
• SMILES: [Pd]12(I)[n]3[n](cnc3)Cc3c2c(C[n]2[n]1cnc2)ccc3
• Title of publication: Novel Chiral and Achiral NCN Pincer Complexes Based on 1,3-Bis(1,2,4-triazol- 1-ylmethyl)benzene
• Authors of publication: Díez-Barra, E.; Guerra, J.; López-Solera, Isabel; Merino, S.; Rodríguez-López, J.; Sánchez-Verdú, P.; Tejeda, J.
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 19.254 ± 0.002 Å
• b: 8.222 ± 0.002 Å
• c: 18.454 ± 0.001 Å
• α: 90°
• β: 108.2 ± 0.2°
• γ: 90°
• Cell volume: 2775.2 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No