双[3-[[4,5-二氢基-3-甲基-5-(氧代- κO)-1-苯基-1H-呲唑-4-基]偶氮-κ N1]-4-(羟基-κO)苯磺酰胺根合(2-)] 铬酸钠(1-)
sodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzenesulfonimidate;2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]-4-sulfamoylphenolate · CAS 72275-69-5
- 中文名
- 双[3-[[4,5-二氢基-3-甲基-5-(氧代- κO)-1-苯基-1H-呲唑-4-基]偶氮-κ N1]-4-(羟基-κO)苯磺酰胺根合(2-)] 铬酸钠(1-)
- 中文别名
- 暂无
- 英文名
- sodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzenesulfonimidate;2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]-4-sulfamoylphenolate
- CAS
- 72275-69-5
- CID
- 138401811
- IUPAC 名称
- sodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzenesulfonimidate;2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]-4-sulfamoylphenolate
名称与编号
- 中文名
- 双[3-[[4,5-二氢基-3-甲基-5-(氧代- κO)-1-苯基-1H-呲唑-4-基]偶氮-κ N1]-4-(羟基-κO)苯磺酰胺根合(2-)] 铬酸钠(1-)
- 中文别名
- 暂无
- 英文名
- sodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzenesulfonimidate;2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]-4-sulfamoylphenolate
- CAS
- 72275-69-5
- CID
- 138401811
- IUPAC 名称
- sodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-4-oxidobenzenesulfonimidate;2-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)diazenyl]-4-sulfamoylphenolate
分子属性
- 分子式
- C32H26CrN10NaO8S2
- 分子量
- 817.7 g/mol
- 精确质量
- 817.067924 Da
- 单同位素质量
- 817.067924 Da
- XLogP
- 暂无
- 极性表面积
- 310 Ų
- 氢键供体
- 3
- 氢键受体
- 16
- 可旋转键
- 8
- 重原子数
- 54
- 净电荷
- 0
- 结构复杂度
- 1320
结构标识
- InChIKey
- LVVWBOCGJIDJDZ-UHFFFAOYSA-J
- SMILES
- CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=N)(=O)[O-])[O-])[O-])C3=CC=CC=C3.[Na+].[Cr+3]
- InChI
- InChI=1S/2C16H15N5O4S.Cr.Na/c2*1-10-15(16(23)21(20-10)11-5-3-2-4-6-11)19-18-13-9-12(26(17,24)25)7-8-14(13)22;;/h2-9,22-23H,1H3,(H2,17,24,25);2-9,20,22H,1H3,(H2,17,24,25);;/q;;+3;+1/p-4