Crystallography Open Database

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Searching journal of publication like 'Physical chemistry chemical physics : PCCP' volume of publication is 18

COD ID: 1544075
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3742
Cell parameters: 15.1215; 14.5537; 17.0259; 90; 92.957; 90;  

COD ID: 1544076
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3732.5
Cell parameters: 15.1192; 14.5268; 17.0178; 90; 93.017; 90;  

COD ID: 1544077
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3589.6
Cell parameters: 15.007; 14.3798; 16.6543; 90; 92.812; 90;  

COD ID: 1544078
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3662.6
Cell parameters: 15.0917; 14.196; 17.1443; 90; 94.31; 90;  

COD ID: 1544079
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3658.2
Cell parameters: 15.092; 14.1832; 17.1387; 90; 94.321; 90;  

COD ID: 1544080
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3726
Cell parameters: 15.1117; 14.5148; 17.011; 90; 93.032; 90;  

COD ID: 1544081
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3677.8
Cell parameters: 15.0934; 14.2495; 17.147; 90; 94.234; 90;  

COD ID: 1544082
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3718.2
Cell parameters: 15.1103; 14.4939; 17.0017; 90; 93.063; 90;  

COD ID: 1544083
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3738.4
Cell parameters: 15.1196; 14.5444; 17.023; 90; 92.966; 90;  

COD ID: 1544084
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3667.5
Cell parameters: 15.0918; 14.2146; 17.1441; 90; 94.286; 90;  

COD ID: 1544085
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3693.1
Cell parameters: 15.097; 14.3013; 17.1496; 90; 94.136; 90;  

COD ID: 1544086
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3682.3
Cell parameters: 15.094; 14.2636; 17.1499; 90; 94.206; 90;  

COD ID: 1544087
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3687.8
Cell parameters: 15.0958; 14.2842; 17.1476; 90; 94.159; 90;  

COD ID: 1544088
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3709.4
Cell parameters: 15.1034; 14.3594; 17.1456; 90; 94.006; 90;  

COD ID: 1544089
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3698.7
Cell parameters: 15.0995; 14.3215; 17.1475; 90; 94.087; 90;  

COD ID: 1544090
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3746.3
Cell parameters: 15.1239; 14.5665; 17.0273; 90; 92.929; 90;  

COD ID: 1544091
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3724.8
Cell parameters: 15.1158; 14.507; 17.0102; 90; 93.051; 90;  

COD ID: 1544092
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3727.8
Cell parameters: 15.1104; 14.4217; 17.1457; 90; 93.883; 90;  

COD ID: 1544093
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3742.9
Cell parameters: 15.1213; 14.5553; 17.0282; 90; 92.945; 90;  

COD ID: 1544094
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3753.8
Cell parameters: 15.1221; 14.5091; 17.1448; 90; 93.707; 90;  

COD ID: 1544095
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3703.5
Cell parameters: 15.1005; 14.3391; 17.147; 90; 94.05; 90;  

COD ID: 1544096
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3741.3
Cell parameters: 15.117; 14.4666; 17.1452; 90; 93.793; 90;  

COD ID: 1544097
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3767.9
Cell parameters: 15.1281; 14.555; 17.1464; 90; 93.621; 90;  

COD ID: 1544098
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3761.5
Cell parameters: 15.1251; 14.5335; 17.1467; 90; 93.657; 90;  

COD ID: 1544099
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3672.7
Cell parameters: 15.092; 14.2288; 17.1508; 90; 94.277; 90;  

COD ID: 1544100
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3747.7
Cell parameters: 15.1195; 14.4879; 17.1458; 90; 93.756; 90;  

COD ID: 1544101
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3775.7
Cell parameters: 15.13; 14.5806; 17.1485; 90; 93.558; 90;  

COD ID: 1544102
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3734.2
Cell parameters: 15.1135; 14.4437; 17.1447; 90; 93.836; 90;  

COD ID: 1544103
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3721.5
Cell parameters: 15.1082; 14.4006; 17.1451; 90; 93.924; 90;  

COD ID: 1544104
CIF file Formula: - C38 H28 N10 S2 Zn -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3715.2
Cell parameters: 15.1058; 14.379; 17.1457; 90; 93.973; 90;  

COD ID: 1544105
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3573.8
Cell parameters: 15.0064; 14.3397; 16.6293; 90; 92.918; 90;  

COD ID: 1544106
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3576.6
Cell parameters: 14.9984; 14.3524; 16.635; 90; 92.822; 90;  

COD ID: 1544107
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3596.1
Cell parameters: 15.0133; 14.3893; 16.6664; 90; 92.825; 90;  

COD ID: 1544108
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3578.1
Cell parameters: 15.0068; 14.35; 16.6364; 90; 92.859; 90;  

COD ID: 1544109
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3585.3
Cell parameters: 15.007; 14.3657; 16.6511; 90; 92.856; 90;  

COD ID: 1544110
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3587.2
Cell parameters: 15.0091; 14.3725; 16.6495; 90; 92.839; 90;  

COD ID: 1544111
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3596.4
Cell parameters: 15.0119; 14.3903; 16.6678; 90; 92.793; 90;  

COD ID: 1544112
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3599.1
Cell parameters: 15.0171; 14.3939; 16.6705; 90; 92.807; 90;  

COD ID: 1544113
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3584.8
Cell parameters: 15.009; 14.3641; 16.6475; 90; 92.803; 90;  

COD ID: 1544114
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3603.1
Cell parameters: 15.0178; 14.4001; 16.6809; 90; 92.794; 90;  

COD ID: 1544115
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3634.9
Cell parameters: 15.0534; 14.4184; 16.7682; 90; 92.865; 90;  

COD ID: 1544116
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3664.2
Cell parameters: 15.08; 14.4253; 16.8673; 90; 92.994; 90;  

COD ID: 1544117
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3671.1
Cell parameters: 15.0821; 14.4302; 16.8916; 90; 93.026; 90;  

COD ID: 1544118
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3614.7
Cell parameters: 15.0294; 14.4106; 16.7098; 90; 92.796; 90;  

COD ID: 1544119
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3619.2
Cell parameters: 15.0368; 14.4119; 16.7208; 90; 92.815; 90;  

COD ID: 1544120
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3610.9
Cell parameters: 15.0266; 14.4078; 16.6985; 90; 92.813; 90;  

COD ID: 1544121
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3681.3
Cell parameters: 15.0861; 14.4369; 16.927; 90; 93.073; 90;  

COD ID: 1544122
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3625.2
Cell parameters: 15.0406; 14.4132; 16.7432; 90; 92.832; 90;  

COD ID: 1544123
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3703
Cell parameters: 15.1046; 14.4631; 16.9754; 90; 93.103; 90;  

COD ID: 1544124
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3690.2
Cell parameters: 15.0984; 14.4452; 16.9444; 90; 93.086; 90;  

COD ID: 1544125
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3649.9
Cell parameters: 15.0676; 14.4217; 16.8187; 90; 92.929; 90;  

COD ID: 1544126
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3700.1
Cell parameters: 15.1045; 14.4584; 16.9678; 90; 93.103; 90;  

COD ID: 1544127
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3711.5
Cell parameters: 15.1063; 14.4809; 16.9914; 90; 93.085; 90;  

COD ID: 1544128
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3678.3
Cell parameters: 15.0902; 14.4342; 16.9112; 90; 93.056; 90;  

COD ID: 1544129
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3716.6
Cell parameters: 15.1127; 14.4897; 16.9969; 90; 93.083; 90;  

COD ID: 1544130
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3641.9
Cell parameters: 15.0573; 14.42; 16.7947; 90; 92.889; 90;  

COD ID: 1544131
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3693
Cell parameters: 15.0961; 14.4493; 16.955; 90; 93.099; 90;  

COD ID: 1544132
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3708.2
Cell parameters: 15.1081; 14.4721; 16.9844; 90; 93.095; 90;  

COD ID: 1544133
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3656.7
Cell parameters: 15.0713; 14.4223; 16.8453; 90; 92.962; 90;  

COD ID: 1544134
CIF file Formula: - C38 H28 Fe N10 S2 -
Comments: Lakhloufi, S.; Lemée-Cailleau, M H; Chastanet, G.; Rosa, P.; Daro, N.; Guionneau, P. Structural movies of the gradual spin-crossover in a molecular complex at various physical scales. Physical chemistry chemical physics : PCCP 18(40) (2016) 28307-28315
Space group: P 1 21/c 1
Cell volume: 3732.9
Cell parameters: 15.1186; 14.5293; 17.0171; 90; 93.012; 90;  

COD ID: 7223319
CIF file Formula: - C46 H68 N2 S2 -
Comments: Chen, Jianhua; Xiao, Manjun; Duan, Linrui; Wang, Qiong; Tan, Hua; Su, Ning; Liu, Yu; Yang, Renqiang; Zhu, Weiguo Benzodi(pyridothiophene): a novel acceptor unit for application in A1-A-A1 type photovoltaic small molecules. Physical chemistry chemical physics : PCCP 18(3) (2016) 1507-1515
Space group: P -1
Cell volume: 1057.26
Cell parameters: 5.5193; 8.7116; 23.1468; 84.894; 88.701; 72.509;  

COD ID: 7223426
CIF file Formula: - C16 H21 Br O Si -
Comments: Beckmann, Peter A.; Moore, Curtis E.; Rheingold, Arnold L. Methyl and t-butyl group rotation in a molecular solid: (1)H NMR spin-lattice relaxation and X-ray diffraction. Physical chemistry chemical physics : PCCP 18(3) (2016) 1720-1726
Space group: P 1 21 1
Cell volume: 820.66
Cell parameters: 7.0513; 7.6501; 15.5178; 90; 101.367; 90;  

COD ID: 7223530
CIF file Formula: - C47 H39 N -
Comments: Kuck, Dietmar; Linke, Jens; Teichmann, Lisa Christin; Barth, Dieter; Tellenbröker, Jörg; Gestmann, Detlef; Neumann, Beate; Stammler, Hans-Georg; Bögge, Hartmut Centrohexaindane: six benzene rings mutually fixed in three dimensions - solid-state structure and six-fold nitration. Physical chemistry chemical physics : PCCP 18(17) (2016) 11722-11737
Space group: P n m a
Cell volume: 3324.1
Cell parameters: 15.6323; 14.7468; 14.4198; 90; 90; 90;  

COD ID: 7223531
CIF file Formula: - C42 H25 Cl3 -
Comments: Kuck, Dietmar; Linke, Jens; Teichmann, Lisa Christin; Barth, Dieter; Tellenbröker, Jörg; Gestmann, Detlef; Neumann, Beate; Stammler, Hans-Georg; Bögge, Hartmut Centrohexaindane: six benzene rings mutually fixed in three dimensions - solid-state structure and six-fold nitration. Physical chemistry chemical physics : PCCP 18(17) (2016) 11722-11737
Space group: P -1
Cell volume: 1480.35
Cell parameters: 8.51239; 12.4653; 14.2625; 91.3139; 93.6817; 101.235;  

COD ID: 7223532
CIF file Formula: - C45 H29 -
Comments: Kuck, Dietmar; Linke, Jens; Teichmann, Lisa Christin; Barth, Dieter; Tellenbröker, Jörg; Gestmann, Detlef; Neumann, Beate; Stammler, Hans-Georg; Bögge, Hartmut Centrohexaindane: six benzene rings mutually fixed in three dimensions - solid-state structure and six-fold nitration. Physical chemistry chemical physics : PCCP 18(17) (2016) 11722-11737
Space group: P 1 21/c 1
Cell volume: 2918.64
Cell parameters: 8.42; 14.384; 24.107; 90; 91.53; 90;  

COD ID: 7223553
CIF file Formula: - C84 H72 N8 O19 S24 -
Comments: Xue, Li-Jun; Huo, Peng; Li, Yan-Hong; Hou, Jin-Le; Zhu, Qin-Yu; Dai, Jie An ionic charge-transfer dyad prepared cost-effectively from a tetrathiafulvalene carboxylate anion and a TMPyP cation. Physical chemistry chemical physics : PCCP 18(4) (2016) 2940-2948
Space group: P 1 21/m 1
Cell volume: 4952.4
Cell parameters: 10.8302; 33.4895; 13.8319; 90; 99.191; 90;  

COD ID: 7223554
CIF file Formula: - C64 H52 N8 O21 S8 -
Comments: Xue, Li-Jun; Huo, Peng; Li, Yan-Hong; Hou, Jin-Le; Zhu, Qin-Yu; Dai, Jie An ionic charge-transfer dyad prepared cost-effectively from a tetrathiafulvalene carboxylate anion and a TMPyP cation. Physical chemistry chemical physics : PCCP 18(4) (2016) 2940-2948
Space group: C 1 2/c 1
Cell volume: 6421.3
Cell parameters: 23.6681; 22.0587; 13.2272; 90; 111.589; 90;  

COD ID: 7223851
CIF file Formula: - C30 H21 F6 Mn O6 -
Comments: Carli, Stefano; Benazzi, Elisabetta; Casarin, Laura; Bernardi, Tatiana; Bertolasi, Valerio; Argazzi, Roberto; Caramori, Stefano; Bignozzi, Carlo Alberto On the stability of manganese tris(β-diketonate) complexes as redox mediators in DSSCs. Physical chemistry chemical physics : PCCP 18(8) (2016) 5949-5956
Space group: R -3 :H
Cell volume: 4337.3
Cell parameters: 18.583; 18.583; 14.503; 90; 90; 120;  

COD ID: 7223852
CIF file Formula: - C28 H40 Cl Mn N2 O8 -
Comments: Carli, Stefano; Benazzi, Elisabetta; Casarin, Laura; Bernardi, Tatiana; Bertolasi, Valerio; Argazzi, Roberto; Caramori, Stefano; Bignozzi, Carlo Alberto On the stability of manganese tris(β-diketonate) complexes as redox mediators in DSSCs. Physical chemistry chemical physics : PCCP 18(8) (2016) 5949-5956
Space group: C 1 2/c 1
Cell volume: 3252.7
Cell parameters: 16.325; 17.663; 12.491; 90; 115.434; 90;  

COD ID: 7223853
CIF file Formula: - C38 H40 F4 Mn N2 O4 -
Comments: Carli, Stefano; Benazzi, Elisabetta; Casarin, Laura; Bernardi, Tatiana; Bertolasi, Valerio; Argazzi, Roberto; Caramori, Stefano; Bignozzi, Carlo Alberto On the stability of manganese tris(β-diketonate) complexes as redox mediators in DSSCs. Physical chemistry chemical physics : PCCP 18(8) (2016) 5949-5956
Space group: C 1 2/c 1
Cell volume: 3656.4
Cell parameters: 18.2229; 19.0407; 11.7031; 90; 115.785; 90;  

COD ID: 7223984
CIF file Formula: - C60 H24 N8 O8 Zn3 -
Comments: Sakuma, Takao; Sakai, Hayato; Araki, Yasuyuki; Wada, Takehiko; Hasobe, Taku Control of local structures and photophysical properties of zinc porphyrin-based supramolecular assemblies structurally organized by regioselective ligand coordination. Physical chemistry chemical physics : PCCP 18(7) (2016) 5453-5463
Space group: I 4/m m m
Cell volume: 4916.7
Cell parameters: 16.679; 16.679; 17.674; 90; 90; 90;  

COD ID: 7223985
CIF file Formula: - C10 F8 -
Comments: Dobrowolski, Michał A; Cyrański, Michał K; Wróbel, Zbigniew Cyclic π-electron delocalization in non-planar linear acenes. Physical chemistry chemical physics : PCCP 18(17) (2016) 11813-11820
Space group: P 1 21/c 1
Cell volume: 1269.61
Cell parameters: 13.3203; 4.8791; 19.8516; 90; 100.245; 90;  

COD ID: 7223986
CIF file Formula: - C10 Cl8 -
Comments: Dobrowolski, Michał A; Cyrański, Michał K; Wróbel, Zbigniew Cyclic π-electron delocalization in non-planar linear acenes. Physical chemistry chemical physics : PCCP 18(17) (2016) 11813-11820
Space group: P 1 21/n 1
Cell volume: 1261.9
Cell parameters: 9.7244; 7.1739; 18.2816; 90; 98.317; 90;  

COD ID: 7223987
CIF file Formula: - C10 Br8 -
Comments: Dobrowolski, Michał A; Cyrański, Michał K; Wróbel, Zbigniew Cyclic π-electron delocalization in non-planar linear acenes. Physical chemistry chemical physics : PCCP 18(17) (2016) 11813-11820
Space group: P b c n
Cell volume: 1471.66
Cell parameters: 11.3832; 7.8114; 16.5506; 90; 90; 90;  

COD ID: 7223988
CIF file Formula: - C14 Cl10 -
Comments: Dobrowolski, Michał A; Cyrański, Michał K; Wróbel, Zbigniew Cyclic π-electron delocalization in non-planar linear acenes. Physical chemistry chemical physics : PCCP 18(17) (2016) 11813-11820
Space group: P -1
Cell volume: 815.95
Cell parameters: 7.1558; 9.5084; 12.4684; 75.854; 82.701; 87.954;  

COD ID: 7224087
CIF file Formula: - C8 H14 O12 Zn -
Comments: Ruggiero, Michael T.; Korter, Timothy M. The crucial role of water in shaping low-barrier hydrogen bonds. Physical chemistry chemical physics : PCCP 18(7) (2016) 5521-5528
Space group: P -1
Cell volume: 313.95
Cell parameters: 5.1749; 7.2736; 9.1901; 108.304; 105.213; 92.434;  

COD ID: 7224088
CIF file Formula: - C8 H14 Ni O12 -
Comments: Ruggiero, Michael T.; Korter, Timothy M. The crucial role of water in shaping low-barrier hydrogen bonds. Physical chemistry chemical physics : PCCP 18(7) (2016) 5521-5528
Space group: P -1
Cell volume: 310.38
Cell parameters: 5.142; 7.2793; 9.1121; 108.025; 105.191; 92.14;  

COD ID: 7224089
CIF file Formula: - C8 H14 Co O12 -
Comments: Ruggiero, Michael T.; Korter, Timothy M. The crucial role of water in shaping low-barrier hydrogen bonds. Physical chemistry chemical physics : PCCP 18(7) (2016) 5521-5528
Space group: P -1
Cell volume: 313.79
Cell parameters: 5.1742; 7.2742; 9.2053; 108.809; 105.003; 92.409;  

COD ID: 7224090
CIF file Formula: - C8 H14 Fe O12 -
Comments: Ruggiero, Michael T.; Korter, Timothy M. The crucial role of water in shaping low-barrier hydrogen bonds. Physical chemistry chemical physics : PCCP 18(7) (2016) 5521-5528
Space group: P -1
Cell volume: 318.98
Cell parameters: 5.2115; 7.3307; 9.2529; 109.019; 105.339; 92.53;  

COD ID: 7224091
CIF file Formula: - C8 H14 Mn O12 -
Comments: Ruggiero, Michael T.; Korter, Timothy M. The crucial role of water in shaping low-barrier hydrogen bonds. Physical chemistry chemical physics : PCCP 18(7) (2016) 5521-5528
Space group: P -1
Cell volume: 326.37
Cell parameters: 5.2823; 7.3398; 9.3651; 109.765; 105.152; 92.454;  

COD ID: 7224132
CIF file Formula: - C36 H50 O6 S2 -
Comments: Bowen, Alice M.; Jones, Michael W.; Lovett, Janet E.; Gaule, Thembanikosi G.; McPherson, Michael J.; Dilworth, Jonathan R.; Timmel, Christiane R.; Harmer, Jeffrey R. Exploiting orientation-selective DEER: determining molecular structure in systems containing Cu(ii) centres. Physical chemistry chemical physics : PCCP 18(8) (2016) 5981-5994
Space group: P 1 21/a 1
Cell volume: 1764.34
Cell parameters: 14.1458; 7.2193; 17.4712; 90; 98.5591; 90;  

COD ID: 7224138
CIF file Formula: - Al Li3 O5 Si -
Comments: Chen, Xinglong; Zhang, Fangfang; Liu, Lili; Lei, Bing-Hua; Dong, Xiaoyu; Yang, Zhihua; Li, Hongyi; Pan, Shilie Li3AlSiO5: the first aluminosilicate as a potential deep-ultraviolet nonlinear optical crystal with the quaternary diamond-like structure. Physical chemistry chemical physics : PCCP 18(6) (2016) 4362-4369
Space group: P n a 21
Cell volume: 396.4
Cell parameters: 5.331; 15.551; 4.782; 90; 90; 90;  

COD ID: 7224310
CIF file Formula: - C8 H14 Fe2 N O12 -
Comments: Sieradzki, A.; Pawlus, S.; Tripathy, S. N.; Gągor, A; Ciupa, A.; Mączka, M; Paluch, M. Dielectric relaxation behavior in antiferroelectric metal organic framework [(CH3)2NH2][Fe(III)Fe(II)(HCOO)6] single crystals. Physical chemistry chemical physics : PCCP 18(12) (2016) 8462-8467
Space group: R -3 c :H
Cell volume: 7341.3
Cell parameters: 14.2909; 14.2909; 41.5072; 90; 90; 120;  

COD ID: 7224311
CIF file Formula: - C8 H14 Fe2 N O12 -
Comments: Sieradzki, A.; Pawlus, S.; Tripathy, S. N.; Gągor, A; Ciupa, A.; Mączka, M; Paluch, M. Dielectric relaxation behavior in antiferroelectric metal organic framework [(CH3)2NH2][Fe(III)Fe(II)(HCOO)6] single crystals. Physical chemistry chemical physics : PCCP 18(12) (2016) 8462-8467
Space group: P -3 1 c
Cell volume: 818.21
Cell parameters: 8.2603; 8.2603; 13.8466; 90; 90; 120;  

COD ID: 7224312
CIF file Formula: - C8 H14 Fe2 N O12 -
Comments: Sieradzki, A.; Pawlus, S.; Tripathy, S. N.; Gągor, A; Ciupa, A.; Mączka, M; Paluch, M. Dielectric relaxation behavior in antiferroelectric metal organic framework [(CH3)2NH2][Fe(III)Fe(II)(HCOO)6] single crystals. Physical chemistry chemical physics : PCCP 18(12) (2016) 8462-8467
Space group: R -3 c :H
Cell volume: 7337.1
Cell parameters: 14.2916; 14.2916; 41.4795; 90; 90; 120;  

COD ID: 7224313
CIF file Formula: - C8 H14 Fe2 N O12 -
Comments: Sieradzki, A.; Pawlus, S.; Tripathy, S. N.; Gągor, A; Ciupa, A.; Mączka, M; Paluch, M. Dielectric relaxation behavior in antiferroelectric metal organic framework [(CH3)2NH2][Fe(III)Fe(II)(HCOO)6] single crystals. Physical chemistry chemical physics : PCCP 18(12) (2016) 8462-8467
Space group: R -3 c :H
Cell volume: 7354.8
Cell parameters: 14.2991; 14.2991; 41.5361; 90; 90; 120;  

COD ID: 7224314
CIF file Formula: - C8 H14 Fe2 N O12 -
Comments: Sieradzki, A.; Pawlus, S.; Tripathy, S. N.; Gągor, A; Ciupa, A.; Mączka, M; Paluch, M. Dielectric relaxation behavior in antiferroelectric metal organic framework [(CH3)2NH2][Fe(III)Fe(II)(HCOO)6] single crystals. Physical chemistry chemical physics : PCCP 18(12) (2016) 8462-8467
Space group: R -3 c :H
Cell volume: 7335.7
Cell parameters: 14.2896; 14.2896; 41.483; 90; 90; 120;  

COD ID: 7224460
CIF file Formula: - C107.5 H109 Cu F12 N8 O10.5 P2 -
Comments: Meyer, Andreas; Abdullin, Dinar; Schnakenburg, Gregor; Schiemann, Olav Single and double nitroxide labeled bis(terpyridine)-copper(ii): influence of orientation selectivity and multispin effects on PELDOR and RIDME. Physical chemistry chemical physics : PCCP 18(13) (2016) 9262-9271
Space group: P -1
Cell volume: 10142.9
Cell parameters: 20.1608; 22.3481; 25.738; 71.678; 67.478; 86.691;  

COD ID: 7224567
CIF file Formula: - C12 H20 F3 N5 O4 S -
Comments: Solel, Ephrath; Singh, Mandeep; Reany, Ofer; Keinan, Ehud Enhanced anion binding by heteroatom replacement in bambusurils. Physical chemistry chemical physics : PCCP 18(19) (2016) 13180-13185
Space group: P -1
Cell volume: 845.45
Cell parameters: 6.477; 10.584; 12.778; 85.883; 86.565; 75.6;  

COD ID: 7224568
CIF file Formula: - C10 H18 F3 N5 O4 S -
Comments: Solel, Ephrath; Singh, Mandeep; Reany, Ofer; Keinan, Ehud Enhanced anion binding by heteroatom replacement in bambusurils. Physical chemistry chemical physics : PCCP 18(19) (2016) 13180-13185
Space group: P 1 21/n 1
Cell volume: 1477.29
Cell parameters: 6.563; 14.3405; 15.7391; 90; 94.225; 90;  

COD ID: 7224569
CIF file Formula: - C20 H29 F6 O P Ru -
Comments: Higashi, Tomomi; Ueda, Takahiro; Mochida, Tomoyuki Effects of substituent branching and chirality on the physical properties of ionic liquids based on cationic ruthenium sandwich complexes. Physical chemistry chemical physics : PCCP 18(15) (2016) 10041-10048
Space group: P -1
Cell volume: 1088.4
Cell parameters: 10.389; 10.393; 11.05; 84.703; 67.159; 82.242;  

COD ID: 7224570
CIF file Formula: - C20 H29 F2 N O5 Ru S2 -
Comments: Higashi, Tomomi; Ueda, Takahiro; Mochida, Tomoyuki Effects of substituent branching and chirality on the physical properties of ionic liquids based on cationic ruthenium sandwich complexes. Physical chemistry chemical physics : PCCP 18(15) (2016) 10041-10048
Space group: P -1
Cell volume: 1158.3
Cell parameters: 7.928; 9.542; 16.403; 98.073; 101.571; 103.61;  

COD ID: 7224571
CIF file Formula: - C20 H29 F6 O P Ru -
Comments: Higashi, Tomomi; Ueda, Takahiro; Mochida, Tomoyuki Effects of substituent branching and chirality on the physical properties of ionic liquids based on cationic ruthenium sandwich complexes. Physical chemistry chemical physics : PCCP 18(15) (2016) 10041-10048
Space group: P -1
Cell volume: 2197.4
Cell parameters: 7.24; 18.137; 18.786; 114.703; 94.018; 97.896;  

COD ID: 7224637
CIF file Formula: - C10 H15 F -
Comments: Ben Hassine, B.; Negrier, Ph; Romanini, M.; Barrio, M.; Macovez, R.; Kallel, A.; Mondieig, D.; Tamarit, J. Ll Structure and reorientational dynamics of 1-F-adamantane. Physical chemistry chemical physics : PCCP 18(16) (2016) 10924-10930
Space group: F m -3 m
Cell volume: 871.59
Cell parameters: 9.5522; 9.5522; 9.5522; 90; 90; 90;  

COD ID: 7224638
CIF file Formula: - C10 H15 F -
Comments: Ben Hassine, B.; Negrier, Ph; Romanini, M.; Barrio, M.; Macovez, R.; Kallel, A.; Mondieig, D.; Tamarit, J. Ll Structure and reorientational dynamics of 1-F-adamantane. Physical chemistry chemical physics : PCCP 18(16) (2016) 10924-10930
Space group: P -4 21 c
Cell volume: 405.32
Cell parameters: 6.7776; 6.7776; 8.8235; 90; 90; 90;  

COD ID: 7224706
CIF file Formula: - C8 H20 N6 S2 -
Comments: Ji, Chengmin; Li, Shenhui; Deng, Feng; Liu, Sijie; Asghar, Muhammad Adnan; Sun, Zhihua; Hong, Maochun; Luo, Junhua Bistable N-HN hydrogen bonds for reversibly modulating the dynamic motion in an organic co-crystal. Physical chemistry chemical physics : PCCP 18(16) (2016) 10868-10872
Space group: C 1 2/c 1
Cell volume: 5315
Cell parameters: 19.106; 15.504; 18.03; 90; 95.648; 90;  

COD ID: 7224707
CIF file Formula: - C8 H20 N6 S2 -
Comments: Ji, Chengmin; Li, Shenhui; Deng, Feng; Liu, Sijie; Asghar, Muhammad Adnan; Sun, Zhihua; Hong, Maochun; Luo, Junhua Bistable N-HN hydrogen bonds for reversibly modulating the dynamic motion in an organic co-crystal. Physical chemistry chemical physics : PCCP 18(16) (2016) 10868-10872
Space group: C 1 2/c 1
Cell volume: 1384
Cell parameters: 9.685; 7.867; 18.241; 90; 95.266; 90;  

COD ID: 7224778
CIF file Formula: - C9 H9 F9 Li O9 P -
Comments: Malliakas, Christos D.; Leung, Kevin; Pupek, Krzysztof Z.; Shkrob, Ilya A.; Abraham, Daniel P. Spontaneous aggregation of lithium ion coordination polymers in fluorinated electrolytes for high-voltage batteries. Physical chemistry chemical physics : PCCP 18(16) (2016) 10846-10849
Space group: P -3
Cell volume: 808.03
Cell parameters: 13.0094; 13.0094; 5.5129; 90; 90; 120;  

COD ID: 7224879
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 760.2
Cell parameters: 5.577; 7.5481; 18.06; 90; 90; 90;  

COD ID: 7224880
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 716.43
Cell parameters: 5.3889; 7.4568; 17.8288; 90; 90; 90;  

COD ID: 7224881
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 713
Cell parameters: 5.375; 7.436; 17.849; 90; 90; 90;  

COD ID: 7224882
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 677
Cell parameters: 4.609; 8.438; 17.4; 90; 90; 90;  

COD ID: 7224883
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 672.7
Cell parameters: 4.62; 8.422; 17.29; 90; 90; 90;  

COD ID: 7224884
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 662
Cell parameters: 4.58; 8.401; 17.2; 90; 90; 90;  

COD ID: 7224885
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 660.3
Cell parameters: 4.5744; 8.386; 17.212; 90; 90; 90;  

COD ID: 7224886
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 778.7
Cell parameters: 5.6684; 7.572; 18.1425; 90; 90; 90;  

COD ID: 7224887
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 774.96
Cell parameters: 5.6537; 7.5619; 18.1266; 90; 90; 90;  

COD ID: 7224888
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 771.75
Cell parameters: 5.64474; 7.55135; 18.1054; 90; 90; 90;  

COD ID: 7224889
CIF file Formula: - C6 H12 O6 -
Comments: Patyk, Ewa; Jenczak, Anna; Katrusiak, Andrzej Giant strain geared to transformable H-bonded network in compressed β-d-mannose. Physical chemistry chemical physics : PCCP 18(16) (2016) 11474-11479
Space group: P 21 21 21
Cell volume: 768.01
Cell parameters: 5.62999; 7.5401; 18.0919; 90; 90; 90;  

COD ID: 7225011
CIF file Formula: - C42 H54 Cl6 N10 Pt -
Comments: Serebryanskaya, Tatiyana V.; Novikov, Alexander S.; Gushchin, Pavel V.; Haukka, Matti; Asfin, Ruslan E.; Tolstoy, Peter M.; Kukushkin, Vadim Yu Identification and H(D)-bond energies of C-H(D)Cl interactions in chloride-haloalkane clusters: a combined X-ray crystallographic, spectroscopic, and theoretical study. Physical chemistry chemical physics : PCCP 18(20) (2016) 14104-14112
Space group: P 1 21/c 1
Cell volume: 2302.4
Cell parameters: 9.3446; 9.4052; 26.2178; 90; 92.274; 90;  

COD ID: 7225012
CIF file Formula: - C40 H50 Cl6 N10 Pt -
Comments: Serebryanskaya, Tatiyana V.; Novikov, Alexander S.; Gushchin, Pavel V.; Haukka, Matti; Asfin, Ruslan E.; Tolstoy, Peter M.; Kukushkin, Vadim Yu Identification and H(D)-bond energies of C-H(D)Cl interactions in chloride-haloalkane clusters: a combined X-ray crystallographic, spectroscopic, and theoretical study. Physical chemistry chemical physics : PCCP 18(20) (2016) 14104-14112
Space group: P -1
Cell volume: 2176.92
Cell parameters: 12.9443; 13.0808; 15.1903; 109.653; 113.249; 92.7;  

COD ID: 7225013
CIF file Formula: - C42 H50 Br12 Cl2 N10 Pt -
Comments: Serebryanskaya, Tatiyana V.; Novikov, Alexander S.; Gushchin, Pavel V.; Haukka, Matti; Asfin, Ruslan E.; Tolstoy, Peter M.; Kukushkin, Vadim Yu Identification and H(D)-bond energies of C-H(D)Cl interactions in chloride-haloalkane clusters: a combined X-ray crystallographic, spectroscopic, and theoretical study. Physical chemistry chemical physics : PCCP 18(20) (2016) 14104-14112
Space group: P b c a
Cell volume: 5995
Cell parameters: 14.2649; 18.1921; 23.1012; 90; 90; 90;  

COD ID: 7225014
CIF file Formula: - C42 H46 Cl14 D2 N10 Pt -
Comments: Serebryanskaya, Tatiyana V.; Novikov, Alexander S.; Gushchin, Pavel V.; Haukka, Matti; Asfin, Ruslan E.; Tolstoy, Peter M.; Kukushkin, Vadim Yu Identification and H(D)-bond energies of C-H(D)Cl interactions in chloride-haloalkane clusters: a combined X-ray crystallographic, spectroscopic, and theoretical study. Physical chemistry chemical physics : PCCP 18(20) (2016) 14104-14112
Space group: P b c a
Cell volume: 5584.26
Cell parameters: 13.1946; 17.8886; 23.6588; 90; 90; 90;  

COD ID: 7225015
CIF file Formula: - C48 H65 Co N3 O4 -
Comments: Ghosh, Pritam; Banerjee, Priyabrata How paramagnetic and diamagnetic LMOCs detect picric acid from surface water and the intracellular environment: a combined experimental and DFT-D3 study. Physical chemistry chemical physics : PCCP 18(33) (2016) 22805-22815
Space group: P 1 21/c 1
Cell volume: 4586
Cell parameters: 17.028; 16.746; 17.575; 90; 113.781; 90;  

COD ID: 7225016
CIF file Formula: - C46 H24 F2 N4 S4 -
Comments: Qin, Yunke; Cheng, Changli; Geng, Hua; Wang, Chao; Hu, Wenping; Xu, Wei; Shuai, Zhigang; Zhu, Daoben Efficient ambipolar transport properties in alternate stacking donor-acceptor complexes: from experiment to theory. Physical chemistry chemical physics : PCCP 18(20) (2016) 14094-14103
Space group: P -1
Cell volume: 882.2
Cell parameters: 7.9146; 10.34; 11.03; 89.02; 80.45; 82.36;  

COD ID: 7225017
CIF file Formula: - C46 H24 N6 S5 -
Comments: Qin, Yunke; Cheng, Changli; Geng, Hua; Wang, Chao; Hu, Wenping; Xu, Wei; Shuai, Zhigang; Zhu, Daoben Efficient ambipolar transport properties in alternate stacking donor-acceptor complexes: from experiment to theory. Physical chemistry chemical physics : PCCP 18(20) (2016) 14094-14103
Space group: P -1
Cell volume: 929
Cell parameters: 7.7712; 11.266; 11.337; 74.094; 78.856; 80.05;  

COD ID: 7225018
CIF file Formula: - C46 H22 F4 N4 S4 -
Comments: Qin, Yunke; Cheng, Changli; Geng, Hua; Wang, Chao; Hu, Wenping; Xu, Wei; Shuai, Zhigang; Zhu, Daoben Efficient ambipolar transport properties in alternate stacking donor-acceptor complexes: from experiment to theory. Physical chemistry chemical physics : PCCP 18(20) (2016) 14094-14103
Space group: P -1
Cell volume: 884.5
Cell parameters: 7.9463; 10.099; 11.251; 88.15; 81.09; 82.6;  

COD ID: 7225019
CIF file Formula: - C6 H8 Mg N2 O6 -
Comments: Mączka, Mirosław; Marinho Costa, Nathalia Leal; Gągor, Anna; Paraguassu, Waldeci; Sieradzki, Adam; Hanuza, Jerzy Structural, thermal, dielectric and phonon properties of perovskite-like imidazolium magnesium formate. Physical chemistry chemical physics : PCCP 18(20) (2016) 13993-14000
Space group: P 1 21/n 1
Cell volume: 1849.64
Cell parameters: 12.1246; 12.2087; 12.4991; 90; 91.394; 90;  

COD ID: 7225169
CIF file Formula: - C45 H45 O -
Comments: Sampath, Srinivasan; Boopathi, A. A.; Mandal, A. B. "Bottom-up" self-assembly and "cold crystallization" of butterfly shaped tetrabenzofluorene molecules. Physical chemistry chemical physics : PCCP 18(31) (2016) 21251-21258
Space group: P -1
Cell volume: 1720.38
Cell parameters: 9.6555; 10.5975; 18.1996; 86.088; 85.13; 68.108;  

COD ID: 7225209
CIF file Formula: - C10 H12 F18 N P -
Comments: Han, Xue; Ke, Jie; Suleiman, Norhidayah; Levason, William; Pugh, David; Zhang, Wenjian; Reid, Gillian; Licence, Peter; George, Michael W. Phase behaviour and conductivity of supporting electrolytes in supercritical difluoromethane and 1,1-difluoroethane. Physical chemistry chemical physics : PCCP 18(21) (2016) 14359-14369
Space group: P n m a
Cell volume: 1782.1
Cell parameters: 18.972; 11.8654; 7.9166; 90; 90; 90;  

COD ID: 7225210
CIF file Formula: - C22 H36 F18 N P -
Comments: Han, Xue; Ke, Jie; Suleiman, Norhidayah; Levason, William; Pugh, David; Zhang, Wenjian; Reid, Gillian; Licence, Peter; George, Michael W. Phase behaviour and conductivity of supporting electrolytes in supercritical difluoromethane and 1,1-difluoroethane. Physical chemistry chemical physics : PCCP 18(21) (2016) 14359-14369
Space group: P b c a
Cell volume: 5859.1
Cell parameters: 17.591; 17.971; 18.534; 90; 90; 90;  

COD ID: 7225211
CIF file Formula: - C18 H36 F6 N2 O4 S2 -
Comments: Han, Xue; Ke, Jie; Suleiman, Norhidayah; Levason, William; Pugh, David; Zhang, Wenjian; Reid, Gillian; Licence, Peter; George, Michael W. Phase behaviour and conductivity of supporting electrolytes in supercritical difluoromethane and 1,1-difluoroethane. Physical chemistry chemical physics : PCCP 18(21) (2016) 14359-14369
Space group: P 1 21 1
Cell volume: 5207
Cell parameters: 13.312; 28.997; 13.523; 90; 94.059; 90;  

COD ID: 7225252
CIF file Formula: - C4 H8 O2 -
Comments: McFarlane, Andrew R.; Geller, Hannah; Silverwood, Ian P.; Cooper, Richard I.; Watkin, David J.; Parker, Stewart F.; Winfield, John M.; Lennon, David The application of inelastic neutron scattering to investigate the interaction of methyl propanoate with silica. Physical chemistry chemical physics : PCCP 18(26) (2016) 17210-17216
Space group: P -1
Cell volume: 511.08
Cell parameters: 5.9523; 6.7864; 12.7209; 87.987; 89.585; 84.399;  

COD ID: 7225267
CIF file Formula: - C34 H32 N2 O4 S2 -
Comments: Payne, Abby-Jo; Hendsbee, Arthur D.; McAfee, Seth M.; Paul, Devproshad K.; Karan, Kunal; Welch, Gregory C. Synthesis and structure-property relationships of phthalimide and naphthalimide based organic π-conjugated small molecules. Physical chemistry chemical physics : PCCP 18(21) (2016) 14709-14719
Space group: C 1 2/c 1
Cell volume: 2976.1
Cell parameters: 24.442; 15.052; 8.5086; 90; 108.057; 90;  

COD ID: 7225268
CIF file Formula: - C34 H32 N2 O4 S2 -
Comments: Payne, Abby-Jo; Hendsbee, Arthur D.; McAfee, Seth M.; Paul, Devproshad K.; Karan, Kunal; Welch, Gregory C. Synthesis and structure-property relationships of phthalimide and naphthalimide based organic π-conjugated small molecules. Physical chemistry chemical physics : PCCP 18(21) (2016) 14709-14719
Space group: P 1 21/c 1
Cell volume: 1437
Cell parameters: 5.271; 9.681; 28.26; 90; 94.742; 90;  

COD ID: 7225269
CIF file Formula: - C48 H48 N2 O4 S2 -
Comments: Payne, Abby-Jo; Hendsbee, Arthur D.; McAfee, Seth M.; Paul, Devproshad K.; Karan, Kunal; Welch, Gregory C. Synthesis and structure-property relationships of phthalimide and naphthalimide based organic π-conjugated small molecules. Physical chemistry chemical physics : PCCP 18(21) (2016) 14709-14719
Space group: P -1
Cell volume: 1008
Cell parameters: 8.87; 9.773; 13.13; 94.98; 93.06; 116.609;  

COD ID: 7225270
CIF file Formula: - C34 H32 N2 O4 S2 -
Comments: Payne, Abby-Jo; Hendsbee, Arthur D.; McAfee, Seth M.; Paul, Devproshad K.; Karan, Kunal; Welch, Gregory C. Synthesis and structure-property relationships of phthalimide and naphthalimide based organic π-conjugated small molecules. Physical chemistry chemical physics : PCCP 18(21) (2016) 14709-14719
Space group: P -1
Cell volume: 1460.7
Cell parameters: 7.8929; 13.988; 14.098; 100.29; 99.834; 102.275;  

COD ID: 7225336
CIF file Formula: - C86 H82 B10 N2 -
Comments: Wang, Zhaojin; Jiang, Peng; Wang, Tianyu; Moxey, Graeme J.; Cifuentes, Marie P.; Zhang, Chi; Humphrey, Mark G. Blue-shifted emission and enhanced quantum efficiency viaπ-bridge elongation in carbazole-carborane dyads. Physical chemistry chemical physics : PCCP 18(23) (2016) 15719-15726
Space group: C 1 2/c 1
Cell volume: 11377.6
Cell parameters: 20.1102; 26.5248; 21.3634; 90; 93.228; 90;  

COD ID: 7225555
CIF file Formula: - C33 H27 B F2 N2 -
Comments: Obondi, Christopher O.; Lim, Gary N.; Karr, Paul A.; Nesterov, Vladimir N.; D'Souza, Francis Photoinduced charge separation in wide-band capturing, multi-modular bis(donor styryl)BODIPY-fullerene systems. Physical chemistry chemical physics : PCCP 18(27) (2016) 18187-18200
Space group: P -1
Cell volume: 1282.48
Cell parameters: 8.279; 8.3562; 19.2301; 100.217; 98.258; 96.502;  

COD ID: 7225576
CIF file Formula: - Li O4 P Pb -
Comments: Han, Guopeng; Liu, Qiong; Wang, Ying; Su, Xin; Yang, Zhihua; Pan, Shilie Experimental and theoretical studies on the linear and nonlinear optical properties of lead phosphate crystals LiPbPO4. Physical chemistry chemical physics : PCCP 18(28) (2016) 19123-19129
Space group: P n a 21
Cell volume: 744.8
Cell parameters: 8.027; 18.689; 4.965; 90; 90; 90;  

COD ID: 7225645
CIF file Formula: - C20 H21 Cd N4 O7.5 -
Comments: Gao, Song; Fan, Rui Qing; Wang, Xin Ming; Wei, Li Guo; Song, Yang; Du, Xi; Xing, Kai; Wang, Ping; Yang, Yu Lin Thermally-induced single-crystal-to-single-crystal transformations from a 2D two-fold interpenetrating square lattice layer to a 3D four-fold interpenetrating diamond framework and its application in dye-sensitized solar cells. Physical chemistry chemical physics : PCCP 18(28) (2016) 19001-19010
Space group: P b c n
Cell volume: 4968.2
Cell parameters: 15.8817; 17.5053; 17.8702; 90; 90; 90;  

COD ID: 7225646
CIF file Formula: - C20 H14 Cd N4 O4 -
Comments: Gao, Song; Fan, Rui Qing; Wang, Xin Ming; Wei, Li Guo; Song, Yang; Du, Xi; Xing, Kai; Wang, Ping; Yang, Yu Lin Thermally-induced single-crystal-to-single-crystal transformations from a 2D two-fold interpenetrating square lattice layer to a 3D four-fold interpenetrating diamond framework and its application in dye-sensitized solar cells. Physical chemistry chemical physics : PCCP 18(28) (2016) 19001-19010
Space group: P n n a
Cell volume: 1888.7
Cell parameters: 13.846; 16.556; 8.239; 90; 90; 90;  

COD ID: 7225656
CIF file Formula: - C9 H16 N4 O -
Comments: Zanatta, Marcileia; Girard, Anne-Lise; Marin, Graciane; Ebeling, Gunter; Dos Santos, Francisco P.; Valsecchi, Chiara; Stassen, Hubert; Livotto, Paolo R.; Lewis, William; Dupont, Jairton Confined water in imidazolium based ionic liquids: a supramolecular guest@host complex case. Physical chemistry chemical physics : PCCP 18(27) (2016) 18297-18304
Space group: P 1 21/n 1
Cell volume: 1086.23
Cell parameters: 7.3864; 12.0203; 12.5938; 90; 103.725; 90;  

COD ID: 7225657
CIF file Formula: - C14 H11 F6 N O2 -
Comments: Mróz, M M; Benedini, S.; Forni, A.; Botta, C.; Pasini, D.; Cariati, E.; Virgili, T. Long-living optical gain induced by solvent viscosity in a push-pull molecule. Physical chemistry chemical physics : PCCP 18(27) (2016) 18289-18296
Space group: P 1 21/n 1
Cell volume: 1477.33
Cell parameters: 8.84; 15.0313; 11.9237; 90; 111.183; 90;  

COD ID: 7225758
CIF file Formula: - C120 H120 Au8 N4 O8 P8 S2 -
Comments: Iwasaki, Mitsuhiro; Kobayashi, Naoki; Shichibu, Yukatsu; Konishi, Katsuaki Facile modulation of optical properties of octagold clusters through the control of ligand-mediated interactions. Physical chemistry chemical physics : PCCP 18(28) (2016) 19433-19439
Space group: P 1 21/n 1
Cell volume: 5984.1
Cell parameters: 14.4715; 20.1344; 20.747; 90; 98.1469; 90;  

COD ID: 7225759
CIF file Formula: - C121 H122 Au8 B2 Cl4 F8 N2 O P8 S2 -
Comments: Iwasaki, Mitsuhiro; Kobayashi, Naoki; Shichibu, Yukatsu; Konishi, Katsuaki Facile modulation of optical properties of octagold clusters through the control of ligand-mediated interactions. Physical chemistry chemical physics : PCCP 18(28) (2016) 19433-19439
Space group: C 1 2/c 1
Cell volume: 14115
Cell parameters: 33.432; 17.913; 24.121; 90; 102.277; 90;  

COD ID: 7225828
CIF file Formula: - C72 H78 Al2 Dy2 N6 O18 -
Comments: Peng, Yan; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. Multiple superhyperfine fields in a {DyFe2Dy} coordination cluster revealed using bulk susceptibility and (57)Fe Mössbauer studies. Physical chemistry chemical physics : PCCP 18(31) (2016) 21469-21480
Space group: C 1 2/c 1
Cell volume: 7235.8
Cell parameters: 27.6565; 10.6992; 24.5174; 90; 94.143; 90;  

COD ID: 7225829
CIF file Formula: - C72 H78 Dy2 Fe2 N6 O18 -
Comments: Peng, Yan; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. Multiple superhyperfine fields in a {DyFe2Dy} coordination cluster revealed using bulk susceptibility and (57)Fe Mössbauer studies. Physical chemistry chemical physics : PCCP 18(31) (2016) 21469-21480
Space group: C 1 2/c 1
Cell volume: 7305.4
Cell parameters: 28.4714; 10.5419; 24.4309; 90; 94.949; 90;  

COD ID: 7225830
CIF file Formula: - C25 H17 N5 Ni O3 -
Comments: Majee, Karunamay; Patel, Jully; Rai, Surabhi; Das, Babulal; Panda, Binata; Padhi, Sumanta Kumar Proton reduction by a nickel complex with an internal quinoline moiety for proton relay. Physical chemistry chemical physics : PCCP 18(31) (2016) 21640-21650
Space group: P 1 21/c 1
Cell volume: 2089.46
Cell parameters: 11.5545; 19.8056; 9.1539; 90; 94.097; 90;  

COD ID: 7225851
CIF file Formula: - C12 H19 Cl N2 O2 Sn2 -
Comments: Arjmand, F.; Sharma, S.; Usman, M.; Leu, B. M.; Hu, M. Y.; Toupet, L.; Gosztola, D.; Tabassum, S. Vibrational dynamics (IR, Raman, NRVS) and a DFT study of a new antitumor tetranuclearstannoxane cluster, Sn(iv)-oxo-{di-o-vanillin} dimethyl dichloride. Physical chemistry chemical physics : PCCP 18(27) (2016) 17805-17809
Space group: P 1 21/m 1
Cell volume: 1636.13
Cell parameters: 7.5613; 18.8087; 11.8932; 90; 104.691; 90;  

COD ID: 7225869
CIF file Formula: - C8 H19 Mg N O10 -
Comments: Eisenberg, David; Stroek, Wowa; Geels, Norbert J.; Tanase, Stefania; Ferbinteanu, Marilena; Teat, Simon J.; Mettraux, Pierre; Yan, Ning; Rothenberg, Gadi A rational synthesis of hierarchically porous, N-doped carbon from Mg-based MOFs: understanding the link between nitrogen content and oxygen reduction electrocatalysis. Physical chemistry chemical physics : PCCP 18(30) (2016) 20778-20783
Space group: P n a 21
Cell volume: 2781.8
Cell parameters: 17.8204; 9.9753; 15.6487; 90; 90; 90;  

COD ID: 7225870
CIF file Formula: - C6 H12 K Mg N O9 -
Comments: Eisenberg, David; Stroek, Wowa; Geels, Norbert J.; Tanase, Stefania; Ferbinteanu, Marilena; Teat, Simon J.; Mettraux, Pierre; Yan, Ning; Rothenberg, Gadi A rational synthesis of hierarchically porous, N-doped carbon from Mg-based MOFs: understanding the link between nitrogen content and oxygen reduction electrocatalysis. Physical chemistry chemical physics : PCCP 18(30) (2016) 20778-20783
Space group: P 1 21/n 1
Cell volume: 1173.44
Cell parameters: 7.1443; 10.058; 16.3322; 90; 90.905; 90;  

COD ID: 7226109
CIF file Formula: - C12 H17 N3 O5 -
Comments: Panja, Sumit Kumar; Dwivedi, Nidhi; Saha, Satyen Manipulating the proton transfer process in molecular complexes: synthesis and spectroscopic studies. Physical chemistry chemical physics : PCCP 18(31) (2016) 21600-21609
Space group: P 1 21/c 1
Cell volume: 1365
Cell parameters: 7.5357; 17.1542; 10.8286; 90; 102.802; 90;  

COD ID: 7226110
CIF file Formula: - C14 H8 N2 -
Comments: Panja, Sumit Kumar; Dwivedi, Nidhi; Saha, Satyen Manipulating the proton transfer process in molecular complexes: synthesis and spectroscopic studies. Physical chemistry chemical physics : PCCP 18(31) (2016) 21600-21609
Space group: P 1 21/n 1
Cell volume: 1041.01
Cell parameters: 3.8269; 15.7916; 17.2303; 90; 91.29; 90;  

COD ID: 7226111
CIF file Formula: - C17 H18 N2 O5 -
Comments: Panja, Sumit Kumar; Dwivedi, Nidhi; Saha, Satyen Manipulating the proton transfer process in molecular complexes: synthesis and spectroscopic studies. Physical chemistry chemical physics : PCCP 18(31) (2016) 21600-21609
Space group: P 1 21/n 1
Cell volume: 1679.3
Cell parameters: 9.271; 8.507; 21.337; 90; 93.69; 90;  

COD ID: 7226174
CIF file Formula: - C13 H14 N2 O3 -
Comments: Chatterjee, Tanmay; Mandal, Mrinal; Mandal, Prasun K. Solvent H-bond accepting ability induced conformational change and its influence towards fluorescence enhancement and dual fluorescence of hydroxy meta-GFP chromophore analogue. Physical chemistry chemical physics : PCCP 18(35) (2016) 24332-24342
Space group: P n a 21
Cell volume: 1195.8
Cell parameters: 13.6811; 11.8839; 7.3549; 90; 90; 90;  

COD ID: 7226175
CIF file Formula: - C14 H16 N2 O3 -
Comments: Chatterjee, Tanmay; Mandal, Mrinal; Mandal, Prasun K. Solvent H-bond accepting ability induced conformational change and its influence towards fluorescence enhancement and dual fluorescence of hydroxy meta-GFP chromophore analogue. Physical chemistry chemical physics : PCCP 18(35) (2016) 24332-24342
Space group: P 1 21/n 1
Cell volume: 1363.25
Cell parameters: 8.3642; 7.8279; 20.8234; 90; 90.819; 90;  

COD ID: 7226363
CIF file Formula: - C36 H50 Cu4 I4 N S3 -
Comments: Bonnot, Antoine; Karsenti, Paul-Ludovic; Juvenal, Frank; Golz, Christopher; Strohmann, Carsten; Fortin, Daniel; Knorr, Michael; Harvey, Pierre D. The 3D [(Cu2Br2){μ-EtS(CH2)4SEt}]n material: a rare example of a coordination polymer exhibiting triplet-triplet annihilation. Physical chemistry chemical physics : PCCP 18(36) (2016) 24845-24849
Space group: P -1
Cell volume: 2183.3
Cell parameters: 12.773; 13.042; 13.81; 76.503; 78.2; 83.064;  

COD ID: 7226364
CIF file Formula: - C59 H89 Cu4 I4 N S4 -
Comments: Bonnot, Antoine; Karsenti, Paul-Ludovic; Juvenal, Frank; Golz, Christopher; Strohmann, Carsten; Fortin, Daniel; Knorr, Michael; Harvey, Pierre D. The 3D [(Cu2Br2){μ-EtS(CH2)4SEt}]n material: a rare example of a coordination polymer exhibiting triplet-triplet annihilation. Physical chemistry chemical physics : PCCP 18(36) (2016) 24845-24849
Space group: P 1 21/n 1
Cell volume: 6612
Cell parameters: 11.9745; 20.6966; 26.9669; 90; 98.373; 90;  

COD ID: 7226478
CIF file Formula: - C Cl2 N O P -
Comments: Li, Dingqing; Schwabedissen, Jan; Stammler, Hans-Georg; Mitzel, Norbert W.; Willner, Helge; Zeng, Xiaoqing Dichlorophosphanyl isocyanate - spectroscopy, conformation and molecular structure in the gas phase and the solid state. Physical chemistry chemical physics : PCCP 18(37) (2016) 26245-26253
Space group: P 1 21/c 1
Cell volume: 497.83
Cell parameters: 10.8078; 6.1587; 7.7148; 90; 104.196; 90;  

COD ID: 7226487
CIF file Formula: - C22 H17 N O4 -
Comments: Lifshits, Liubov M.; Budkina, Darya S.; Singh, Varun; Matveev, Sergey M.; Tarnovsky, Alexander N.; Klosterman, Jeremy K. Solution-state photophysics of N-carbazolyl benzoate esters: dual emission and order of states in twisted push-pull chromophores. Physical chemistry chemical physics : PCCP 18(39) (2016) 27671-27683
Space group: P -1
Cell volume: 1699.07
Cell parameters: 7.3977; 11.6656; 20.3981; 76.247; 83.564; 88.301;  

COD ID: 7226488
CIF file Formula: - C21 H17 N O2 -
Comments: Lifshits, Liubov M.; Budkina, Darya S.; Singh, Varun; Matveev, Sergey M.; Tarnovsky, Alexander N.; Klosterman, Jeremy K. Solution-state photophysics of N-carbazolyl benzoate esters: dual emission and order of states in twisted push-pull chromophores. Physical chemistry chemical physics : PCCP 18(39) (2016) 27671-27683
Space group: P 1 21/c 1
Cell volume: 1533.55
Cell parameters: 20.7631; 3.953; 18.9724; 90; 99.996; 90;  

COD ID: 7226542
CIF file Formula: - C34 H24 Eu F12 N O8 S4 -
Comments: Yi, Sijing; Yao, Meihuan; Wang, Jiao; Chen, Xiao Highly luminescent and stable lyotropic liquid crystals based on a europium β-diketonate complex bridged by an ethylammonium cation. Physical chemistry chemical physics : PCCP 18(39) (2016) 27603-27612
Space group: P -1
Cell volume: 2069.1
Cell parameters: 10.0179; 12.2989; 17.6698; 100.592; 95.431; 102.457;  

COD ID: 7226665
CIF file Formula: - C14 H12 Ag F18 N4 P -
Comments: Pliquett, Daniel; Schulz, Peter S.; Heinemann, Frank W.; Bause, Angela; Wasserscheid, Peter Liquid silver tris(perfluoroethyl)trifluorophosphate salts as new media for propene/propane separation. Physical chemistry chemical physics : PCCP 18(40) (2016) 28242-28253
Space group: P b c a
Cell volume: 4780.5
Cell parameters: 17.6078; 15.0214; 18.074; 90; 90; 90;  

COD ID: 7226666
CIF file Formula: - C10 H6 Ag F18 N2 P -
Comments: Pliquett, Daniel; Schulz, Peter S.; Heinemann, Frank W.; Bause, Angela; Wasserscheid, Peter Liquid silver tris(perfluoroethyl)trifluorophosphate salts as new media for propene/propane separation. Physical chemistry chemical physics : PCCP 18(40) (2016) 28242-28253
Space group: P 1 21/n 1
Cell volume: 1857.3
Cell parameters: 9.6624; 14.99; 12.85; 90; 93.695; 90;  

COD ID: 7226667
CIF file Formula: - C16 H10 Ag F18 N2 P -
Comments: Pliquett, Daniel; Schulz, Peter S.; Heinemann, Frank W.; Bause, Angela; Wasserscheid, Peter Liquid silver tris(perfluoroethyl)trifluorophosphate salts as new media for propene/propane separation. Physical chemistry chemical physics : PCCP 18(40) (2016) 28242-28253
Space group: P 1 21/c 1
Cell volume: 2225.8
Cell parameters: 12.8087; 10.5095; 16.822; 90; 100.596; 90;  

COD ID: 7226671
CIF file Formula: - C17 H79 Eu N19 O24.5 P4 -
Comments: Janicki, Rafał; Kędziorski, Andrzej; Mondry, Anna The first example of ab initio calculations of f-f transitions for the case of [Eu(DOTP)](5-) complex-experiment versus theory. Physical chemistry chemical physics : PCCP 18(40) (2016) 27808-27817
Space group: P 1 2/n 1
Cell volume: 9769
Cell parameters: 26.576; 14.451; 27.285; 90; 111.21; 90;  

COD ID: 7226672
CIF file Formula: - C12 H46 Eu K5 N4 O23 P4 -
Comments: Janicki, Rafał; Kędziorski, Andrzej; Mondry, Anna The first example of ab initio calculations of f-f transitions for the case of [Eu(DOTP)](5-) complex-experiment versus theory. Physical chemistry chemical physics : PCCP 18(40) (2016) 27808-27817
Space group: P 4 c c
Cell volume: 3901.6
Cell parameters: 12.5231; 12.5231; 24.8781; 90; 90; 90;  

COD ID: 7226699
CIF file Formula: - C32 H24 N5 O -
Comments: Dresselhaus, Thomas; Eusterwiemann, Steffen; Matuschek, David R.; Daniliuc, Constantin G.; Janka, Oliver; Pöttgen, Rainer; Studer, Armido; Neugebauer, Johannes Black-box determination of temperature-dependent susceptibilities for crystalline organic radicals with complex magnetic topologies. Physical chemistry chemical physics : PCCP 18(40) (2016) 28262-28273
Space group: P -1
Cell volume: 1237.61
Cell parameters: 10.1252; 10.2626; 13.4382; 97.847; 97.577; 113.879;  

COD ID: 7226700
CIF file Formula: - C25 H23 N4 O Si -
Comments: Dresselhaus, Thomas; Eusterwiemann, Steffen; Matuschek, David R.; Daniliuc, Constantin G.; Janka, Oliver; Pöttgen, Rainer; Studer, Armido; Neugebauer, Johannes Black-box determination of temperature-dependent susceptibilities for crystalline organic radicals with complex magnetic topologies. Physical chemistry chemical physics : PCCP 18(40) (2016) 28262-28273
Space group: C 1 2/c 1
Cell volume: 4624.05
Cell parameters: 19.1687; 16.52; 17.427; 90; 123.08; 90;  

COD ID: 7226701
CIF file Formula: - C22 H15 N4 O -
Comments: Dresselhaus, Thomas; Eusterwiemann, Steffen; Matuschek, David R.; Daniliuc, Constantin G.; Janka, Oliver; Pöttgen, Rainer; Studer, Armido; Neugebauer, Johannes Black-box determination of temperature-dependent susceptibilities for crystalline organic radicals with complex magnetic topologies. Physical chemistry chemical physics : PCCP 18(40) (2016) 28262-28273
Space group: P 1 21/c 1
Cell volume: 1784.2
Cell parameters: 10.513; 18.2406; 10.6648; 90; 119.261; 90;  

COD ID: 7226709
CIF file Formula: - C10 H22 Al N2 Na O12 -
Comments: Ptak, Maciej; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław; Pawlus, S. Phase transitions and chromium(iii) luminescence in perovskite-type [C2H5NH3][Na0.5CrxAl0.5-x(HCOO)3] (x = 0, 0.025, 0.5), correlated with structural, dielectric and phonon properties. Physical chemistry chemical physics : PCCP 18(42) (2016) 29629-29640
Space group: P 1 21/n 1
Cell volume: 900.71
Cell parameters: 8.0388; 9.3156; 12.0288; 90; 90.792; 90;  

COD ID: 7226710
CIF file Formula: - C10 H22 Al N2 Na O12 -
Comments: Ptak, Maciej; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław; Pawlus, S. Phase transitions and chromium(iii) luminescence in perovskite-type [C2H5NH3][Na0.5CrxAl0.5-x(HCOO)3] (x = 0, 0.025, 0.5), correlated with structural, dielectric and phonon properties. Physical chemistry chemical physics : PCCP 18(42) (2016) 29629-29640
Space group: P 1 n 1
Cell volume: 885.88
Cell parameters: 8.0343; 9.231; 11.9465; 90; 90.966; 90;  

COD ID: 7226711
CIF file Formula: - C10 H22 Cr N2 Na O12 -
Comments: Ptak, Maciej; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław; Pawlus, S. Phase transitions and chromium(iii) luminescence in perovskite-type [C2H5NH3][Na0.5CrxAl0.5-x(HCOO)3] (x = 0, 0.025, 0.5), correlated with structural, dielectric and phonon properties. Physical chemistry chemical physics : PCCP 18(42) (2016) 29629-29640
Space group: P 1 n 1
Cell volume: 904.238
Cell parameters: 8.10474; 9.26392; 12.04593; 90; 91.1766; 90;  

COD ID: 7226712
CIF file Formula: - C10 H22 Cr N2 Na O12 -
Comments: Ptak, Maciej; Mączka, Mirosław; Gągor, Anna; Sieradzki, Adam; Bondzior, Bartosz; Dereń, Przemysław; Pawlus, S. Phase transitions and chromium(iii) luminescence in perovskite-type [C2H5NH3][Na0.5CrxAl0.5-x(HCOO)3] (x = 0, 0.025, 0.5), correlated with structural, dielectric and phonon properties. Physical chemistry chemical physics : PCCP 18(42) (2016) 29629-29640
Space group: P 1 21/n 1
Cell volume: 918.68
Cell parameters: 8.1066; 9.3455; 12.1283; 90; 91.062; 90;  

COD ID: 7226772
CIF file Formula: - C15 H13 N3 O4 S -
Comments: Lai, Felcia; Du, Jonathan J.; Williams, Peter A.; Váradi, Linda; Baker, Daniel; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. A comparison of the experimental and theoretical charge density distributions in two polymorphic modifications of piroxicam. Physical chemistry chemical physics : PCCP 18(41) (2016) 28802-28818
Space group: P 1 21/c 1
Cell volume: 1455.82
Cell parameters: 7.034; 14.9894; 13.8939; 90; 96.387; 90;  

COD ID: 7226773
CIF file Formula: - C15 H15 N3 O5 S -
Comments: Lai, Felcia; Du, Jonathan J.; Williams, Peter A.; Váradi, Linda; Baker, Daniel; Groundwater, Paul W.; Overgaard, Jacob; Platts, James A.; Hibbs, David E. A comparison of the experimental and theoretical charge density distributions in two polymorphic modifications of piroxicam. Physical chemistry chemical physics : PCCP 18(41) (2016) 28802-28818
Space group: P -1
Cell volume: 1500.67
Cell parameters: 10.3465; 12.7126; 12.8098; 102.78; 99.985; 108.728;  

COD ID: 7226779
CIF file Formula: - C54 H47 F6 N2 O Os P6 -
Comments: Kamecka, Anna; Suwińska, Kinga; Kapturkiewicz, Andrzej Heteroleptic [Os(H)(CO)(N(∧)N)(tpp)2](+) and [Os(Cl)(CO)(N(∧)N)(tpp)2](+) complexes - comparative studies of their luminescence properties. Physical chemistry chemical physics : PCCP 18(41) (2016) 28982-28996
Space group: P -1
Cell volume: 4847.8
Cell parameters: 14.649; 14.7296; 23.2685; 103.447; 96.362; 91.092;  

COD ID: 7226780
CIF file Formula: - C50.5 H42 Cl F6 N2 O Os P3 -
Comments: Kamecka, Anna; Suwińska, Kinga; Kapturkiewicz, Andrzej Heteroleptic [Os(H)(CO)(N(∧)N)(tpp)2](+) and [Os(Cl)(CO)(N(∧)N)(tpp)2](+) complexes - comparative studies of their luminescence properties. Physical chemistry chemical physics : PCCP 18(41) (2016) 28982-28996
Space group: P 42/n
Cell volume: 9760.1
Cell parameters: 28.557; 28.557; 11.9682; 90; 90; 90;  

COD ID: 7226781
CIF file Formula: - C26 H34 Co N4 O4 -
Comments: Peng, Yan; Bodenstein, Tilmann; Fink, Karin; Mereacre, Valeriu; Anson, Christopher E.; Powell, Annie K. Magnetic anisotropy of a Co(II) single ion magnet with distorted trigonal prismatic coordination: theory and experiment. Physical chemistry chemical physics : PCCP 18(43) (2016) 30135-30143
Space group: P 1 21/n 1
Cell volume: 2379.1
Cell parameters: 16.1119; 7.0151; 21.1805; 90; 96.396; 90;  

COD ID: 7226872
CIF file Formula: - C25 H19 F3 N2 O5 S -
Comments: Emenike, Bright U.; Bey, Sara N.; Spinelle, Ronald A.; Jones, Jacob T.; Yoo, Barney; Zeller, Matthias Cationic CHπ interactions as a function of solvation. Physical chemistry chemical physics : PCCP 18(45) (2016) 30940-30945
Space group: P n a 21
Cell volume: 2289.3
Cell parameters: 27.601; 10.773; 7.699; 90; 90; 90;  

COD ID: 7226893
CIF file Formula: - C40 H55 N O11 S -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: P -1
Cell volume: 1956.4
Cell parameters: 8.296; 10.559; 22.575; 87.07; 89.387; 82.151;  

COD ID: 7226894
CIF file Formula: - C28 H29 N O8 S -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: P -1
Cell volume: 1249.13
Cell parameters: 7.1974; 12.5766; 14.1544; 78.981; 87.111; 83.558;  

COD ID: 7226895
CIF file Formula: - C44 H38 B N O4 -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: P 1 21/c 1
Cell volume: 3414.5
Cell parameters: 13.2946; 11.5487; 22.664; 90; 101.108; 90;  

COD ID: 7226896
CIF file Formula: - C32 H49 N O10 -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: P 1 21/n 1
Cell volume: 3268.4
Cell parameters: 11.301; 6.6661; 43.6661; 90; 96.49; 90;  

COD ID: 7226897
CIF file Formula: - C32 H44 N O8.5 S -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: C 1 2/c 1
Cell volume: 6285
Cell parameters: 43.206; 7.075; 22.126; 90; 111.687; 90;  

COD ID: 7226898
CIF file Formula: - C22 H18 F6 N2 O8 S2 -
Comments: Soulié, Marine; Carayon, Chantal; Saffon, Nathalie; Blanc, Sylvie; Fery-Forgues, Suzanne A comparative study of nine berberine salts in the solid state: optimization of the photoluminescence and self-association properties through the choice of the anion. Physical chemistry chemical physics : PCCP 18(43) (2016) 29999-30008
Space group: P -1
Cell volume: 2441.3
Cell parameters: 7.9779; 14.2778; 21.8106; 86.203; 80.015; 89.901;  

COD ID: 7226957
CIF file Formula: - C15 H16 N2 O4 -
Comments: Stock, Rafaela I.; de Melo, Carlos E. A.; Schramm, Adriana D. S.; Nicoleti, Celso R.; Bortoluzzi, Adailton J.; Heying, Renata da S; Machado, Vanderlei G.; Rezende, Marcos C. Structure-behavior study of a family of "hybrid cyanine" dyes which exhibit inverted solvatochromism. Physical chemistry chemical physics : PCCP 18(47) (2016) 32256-32265
Space group: P 1 21/n 1
Cell volume: 1401.07
Cell parameters: 8.754; 13.5346; 11.9125; 90; 96.941; 90;  

COD ID: 7226958
CIF file Formula: - C13 H8 Br2 N2 O3 -
Comments: Stock, Rafaela I.; de Melo, Carlos E. A.; Schramm, Adriana D. S.; Nicoleti, Celso R.; Bortoluzzi, Adailton J.; Heying, Renata da S; Machado, Vanderlei G.; Rezende, Marcos C. Structure-behavior study of a family of "hybrid cyanine" dyes which exhibit inverted solvatochromism. Physical chemistry chemical physics : PCCP 18(47) (2016) 32256-32265
Space group: P -1
Cell volume: 1336
Cell parameters: 8.5277; 10.575; 15.1816; 93.258; 101.706; 92.719;  

COD ID: 7226959
CIF file Formula: - C26 H19 N O3 -
Comments: Stock, Rafaela I.; de Melo, Carlos E. A.; Schramm, Adriana D. S.; Nicoleti, Celso R.; Bortoluzzi, Adailton J.; Heying, Renata da S; Machado, Vanderlei G.; Rezende, Marcos C. Structure-behavior study of a family of "hybrid cyanine" dyes which exhibit inverted solvatochromism. Physical chemistry chemical physics : PCCP 18(47) (2016) 32256-32265
Space group: P 1 21/c 1
Cell volume: 1941.66
Cell parameters: 11.8923; 12.959; 12.7118; 90; 97.638; 90;  

COD ID: 7226960
CIF file Formula: - C13 H10 Cl2 N2 O4 -
Comments: Stock, Rafaela I.; de Melo, Carlos E. A.; Schramm, Adriana D. S.; Nicoleti, Celso R.; Bortoluzzi, Adailton J.; Heying, Renata da S; Machado, Vanderlei G.; Rezende, Marcos C. Structure-behavior study of a family of "hybrid cyanine" dyes which exhibit inverted solvatochromism. Physical chemistry chemical physics : PCCP 18(47) (2016) 32256-32265
Space group: P 1 21/n 1
Cell volume: 1368.16
Cell parameters: 8.7179; 13.577; 11.6351; 90; 96.555; 90;  

COD ID: 7226961
CIF file Formula: - C15 H13 N3 O5 -
Comments: Stock, Rafaela I.; de Melo, Carlos E. A.; Schramm, Adriana D. S.; Nicoleti, Celso R.; Bortoluzzi, Adailton J.; Heying, Renata da S; Machado, Vanderlei G.; Rezende, Marcos C. Structure-behavior study of a family of "hybrid cyanine" dyes which exhibit inverted solvatochromism. Physical chemistry chemical physics : PCCP 18(47) (2016) 32256-32265
Space group: P -1
Cell volume: 722.1
Cell parameters: 6.6932; 7.6756; 15.1649; 86.795; 85.596; 68.438;  

COD ID: 7226976
CIF file Formula: - C7 H3 Cl F2 O -
Comments: Dey, Dhananjay; Bhandary, Subhrajyoti; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak Energy frameworks and a topological analysis of the supramolecular features in in situ cryocrystallized liquids: tuning the weak interaction landscape via fluorination. Physical chemistry chemical physics : PCCP 18(46) (2016) 31811-31820
Space group: P 1 21/c 1
Cell volume: 684.98
Cell parameters: 3.7798; 18.113; 10.051; 90; 95.479; 90;  

COD ID: 7226977
CIF file Formula: - C7 H2 Cl F3 O -
Comments: Dey, Dhananjay; Bhandary, Subhrajyoti; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak Energy frameworks and a topological analysis of the supramolecular features in in situ cryocrystallized liquids: tuning the weak interaction landscape via fluorination. Physical chemistry chemical physics : PCCP 18(46) (2016) 31811-31820
Space group: P 1 21/c 1
Cell volume: 1413.14
Cell parameters: 13.4138; 5.1617; 20.5882; 90; 97.546; 90;  

COD ID: 7226978
CIF file Formula: - C7 H4 Cl F O -
Comments: Dey, Dhananjay; Bhandary, Subhrajyoti; Thomas, Sajesh P.; Spackman, Mark A.; Chopra, Deepak Energy frameworks and a topological analysis of the supramolecular features in in situ cryocrystallized liquids: tuning the weak interaction landscape via fluorination. Physical chemistry chemical physics : PCCP 18(46) (2016) 31811-31820
Space group: P 1 21/n 1
Cell volume: 682.87
Cell parameters: 3.8275; 10.9838; 16.3303; 90; 95.919; 90;  

COD ID: 7227105
CIF file Formula: - C3 H8 Fe N2 O6 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P n a 21
Cell volume: 799.3
Cell parameters: 8.811; 7.782; 11.657; 90; 90; 90;  

COD ID: 7227106
CIF file Formula: - C3 H8 Fe N2 O6 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P n m a
Cell volume: 808.8
Cell parameters: 8.736; 11.763; 7.871; 90; 90; 90;  

COD ID: 7227107
CIF file Formula: - C3 H8 Fe N2 O6 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P 63
Cell volume: 416.6
Cell parameters: 7.946; 7.946; 7.618; 90; 90; 120;  

COD ID: 7227108
CIF file Formula: - C3 H8 Mn N2 O6 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P 63
Cell volume: 431.4
Cell parameters: 7.988; 7.988; 7.807; 90; 90; 120;  

COD ID: 7227109
CIF file Formula: - C13 H23 Br2 N7 O4 Zn -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P 1 21/c 1
Cell volume: 1952.43
Cell parameters: 11.1965; 13.5143; 12.9627; 90; 95.488; 90;  

COD ID: 7227110
CIF file Formula: - C13 H23 Br2 Cl2 N7 O4 Zn2 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P -1
Cell volume: 1215.85
Cell parameters: 7.5332; 11.2812; 15.5208; 101.693; 98.883; 105.224;  

COD ID: 7227111
CIF file Formula: - C12 H32 Mn4 N8 O24 -
Comments: Mączka, Mirosław; Pasińska, Katarzyna; Ptak, Maciej; Paraguassu, Waldeci; da Silva, Tercio Almeida; Sieradzki, Adam; Pikul, Adam Effect of solvent, temperature and pressure on the stability of chiral and perovskite metal formate frameworks of [NH2NH3][M(HCOO)3] (M = Mn, Fe, Zn). Physical chemistry chemical physics : PCCP 18(46) (2016) 31653-31663
Space group: P 1 21 1
Cell volume: 1715.6
Cell parameters: 16.137; 7.605; 16.14; 90; 119.984; 90;  

COD ID: 7227137
CIF file Formula: - C47 H40 F6 O3 P2 Pd -
Comments: Zhang, Song-Lin; Deng, Zhu-Qin Synthesis and reductive elimination of arylPd(ii) trifluoromethyl complexes: a remarkable concentration effect on chemoselectivity. Physical chemistry chemical physics : PCCP 18(48) (2016) 32664-32667
Space group: P 1 21/n 1
Cell volume: 4184
Cell parameters: 17.5019; 9.8634; 25.5915; 90; 108.725; 90;  

COD ID: 7227150
CIF file Formula: - C4 H4 Mn O6 -
Comments: Hendon, Christopher H.; Pradaux-Caggiano, Fabienne; Hatcher, Lauren E.; Gee, William J.; Wilson, Chick C.; Butler, Keith T.; Carbery, David R.; Walsh, Aron; Melot, Brent C. Magnetic coupling in a hybrid Mn(ii) acetylene dicarboxylate. Physical chemistry chemical physics : PCCP 18(48) (2016) 33329-33334
Space group: C 1 2/c 1
Cell volume: 637.44
Cell parameters: 13.4976; 7.1793; 7.8799; 90; 123.405; 90;  


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