二[4-[4-[[4-[[[3-[(4,5-二氢-3-甲 基-5-氧代-1-苯基-1H-吡唑-4-基)偶 氮]-4-羟基苯基]磺酰基]氨基]苯基] 偶氮]-4,5-二氢-3-甲基-5-氧代-1H- 吡唑-1-基]苯磺酸根]合钴(III)酸三 钠
Cobalt(3+) sodium 4-(3-methyl-4-((4-(((3-((3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-id-4-yl)diazenyl)-4-oxidophenyl)sulfonyl)amino)phenyl)diazenyl)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonate (1:3:2) · CAS 75234-42-3
- 中文名
- 二[4-[4-[[4-[[[3-[(4,5-二氢-3-甲 基-5-氧代-1-苯基-1H-吡唑-4-基)偶 氮]-4-羟基苯基]磺酰基]氨基]苯基] 偶氮]-4,5-二氢-3-甲基-5-氧代-1H- 吡唑-1-基]苯磺酸根]合钴(III)酸三 钠
- 中文别名
- 暂无
- 英文名
- Cobalt(3+) sodium 4-(3-methyl-4-((4-(((3-((3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-id-4-yl)diazenyl)-4-oxidophenyl)sulfonyl)amino)phenyl)diazenyl)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonate (1:3:2)
- CAS
- 75234-42-3
- CID
- 165339971
- IUPAC 名称
- trisodium;cobalt(3+);bis(4-[3-methyl-4-[[4-[[3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-4-oxidophenyl]sulfonylamino]phenyl]diazenyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonate)
名称与编号
- 中文名
- 二[4-[4-[[4-[[[3-[(4,5-二氢-3-甲 基-5-氧代-1-苯基-1H-吡唑-4-基)偶 氮]-4-羟基苯基]磺酰基]氨基]苯基] 偶氮]-4,5-二氢-3-甲基-5-氧代-1H- 吡唑-1-基]苯磺酸根]合钴(III)酸三 钠
- 中文别名
- 暂无
- 英文名
- Cobalt(3+) sodium 4-(3-methyl-4-((4-(((3-((3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-id-4-yl)diazenyl)-4-oxidophenyl)sulfonyl)amino)phenyl)diazenyl)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonate (1:3:2)
- CAS
- 75234-42-3
- CID
- 165339971
- IUPAC 名称
- trisodium;cobalt(3+);bis(4-[3-methyl-4-[[4-[[3-[(3-methyl-5-oxo-1-phenylpyrazol-2-id-4-yl)diazenyl]-4-oxidophenyl]sulfonylamino]phenyl]diazenyl]-5-oxo-4H-pyrazol-1-yl]benzenesulfonate)
分子属性
- 分子式
- C64H48CoN18Na3O16S4
- 分子量
- 1581.3 g/mol
- 精确质量
- 1580.140354 Da
- 单同位素质量
- 1580.140354 Da
- XLogP
- 暂无
- 极性表面积
- 493 Ų
- 氢键供体
- 2
- 氢键受体
- 30
- 可旋转键
- 14
- 重原子数
- 106
- 净电荷
- 0
- 结构复杂度
- 3770
结构标识
- InChIKey
- GLVBAWCIDNTEPT-UHFFFAOYSA-H
- SMILES
- CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)[O-])N=NC4=C([N-]N(C4=O)C5=CC=CC=C5)C)C6=CC=C(C=C6)S(=O)(=O)[O-].CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)[O-])N=NC4=C([N-]N(C4=O)C5=CC=CC=C5)C)C6=CC=C(C=C6)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Co+3]
- InChI
- InChI=1S/2C32H27N9O8S2.Co.3Na/c2*1-19-29(31(43)41(38-19)24-12-14-25(15-13-24)51(47,48)49)35-33-21-8-10-22(11-9-21)39-50(45,46)26-16-17-28(42)27(18-26)34-36-30-20(2)37-40(32(30)44)23-6-4-3-5-7-23;;;;/h2*3-18,29H,1-2H3,(H4,33,34,35,36,37,39,42,44,47,48,49);;;;/q;;+3;3*+1/p-6