Information card for entry 4100153

Structure parameters

• Formula: C35 H49 Mg N3
• Calculated formula: C35 H49 Mg N3
• SMILES: [Mg]12(N(C(=C3[N]1(C(C(=[N]2c1c(cccc1CC)CC)C)=CC=C3)C(C)C)C)c1c(cccc1CC)CC)C(C)C
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 13.247 ± 0.0002 Å
• b: 17.1969 ± 0.0004 Å
• c: 15.0233 ± 0.0003 Å
• α: 90°
• β: 114.499 ± 0.001°
• γ: 90°
• Cell volume: 3114.29 ± 0.11 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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