Information card for entry 2100015

Structure parameters

• Common name: dichloromethane
• Formula: C H2 Cl2
• Calculated formula: C H2 Cl2
• SMILES: C(Cl)Cl
• Title of publication: In-situ high-pressure crystallization and compression of halogen contacts in dichloromethane
• Authors of publication: Marcin Podsiad{λ}o; Kamil F. Dziubek; Andrzej Katrusiak
• Journal of publication: Acta Crystallographica, Section B
• Year of publication: 2005
• Journal volume: 61
• Pages of publication: 595 - 600
• a: 3.924 ± 0.001 Å
• b: 7.793 ± 0.002 Å
• c: 9.335 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 285.46 ± 0.12 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No