[1-[4-[[3,3'-二羟基-4'-[(2-羟基 -6-磺基-1-萘基)偶氮][1,1'-二苯基]-4-基]偶氮]-3-羟基-2,7-萘二磺酯基(7-)]]二-铜酸盐(3-)与二氢和 2,2'-亚氨基二[乙醇](1:3)的化合物

Cuprate(3-), [mu-[4-[2-[3,3'-di(hydroxy-kappaO)-4'-[2-[2-(hydroxy-kappaO)-6-sulfo-1-naphthalenyl]diazenyl-kappaN1][1,1'-biphenyl]-4-yl]diazenyl-kappaN1]-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)]]di-, hydrogen, compd. with 2,2'-iminobis[ethanol] (1:3:3) · CAS 72906-64-0

中文名: [1-[4-[[3,3'-二羟基-4'-[(2-羟基 -6-磺基-1-萘基)偶氮][1,1'-二苯基]-4-基]偶氮]-3-羟基-2,7-萘二磺酯基(7-)]]二-铜酸盐(3-)与二氢和 2,2'-亚氨基二[乙醇](1:3)的化合物
中文别名: 暂无
英文名: Cuprate(3-), [mu-[4-[2-[3,3'-di(hydroxy-kappaO)-4'-[2-[2-(hydroxy-kappaO)-6-sulfo-1-naphthalenyl]diazenyl-kappaN1][1,1'-biphenyl]-4-yl]diazenyl-kappaN1]-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)]]di-, hydrogen, compd. with 2,2'-iminobis[ethanol] (1:3:3)
CAS: 72906-64-0
CID: 175262
IUPAC 名称: dicopper;hydron;tris(2-(2-hydroxyethylamino)ethanol);3-oxido-4-[[2-oxido-4-[3-oxido-4-[(2-oxido-6-sulfonatonaphthalen-1-yl)diazenyl]phenyl]phenyl]diazenyl]naphthalene-2,7-disulfonate

名称与编号

中文名: [1-[4-[[3,3'-二羟基-4'-[(2-羟基 -6-磺基-1-萘基)偶氮][1,1'-二苯基]-4-基]偶氮]-3-羟基-2,7-萘二磺酯基(7-)]]二-铜酸盐(3-)与二氢和 2,2'-亚氨基二[乙醇](1:3)的化合物
中文别名: 暂无
英文名: Cuprate(3-), [mu-[4-[2-[3,3'-di(hydroxy-kappaO)-4'-[2-[2-(hydroxy-kappaO)-6-sulfo-1-naphthalenyl]diazenyl-kappaN1][1,1'-biphenyl]-4-yl]diazenyl-kappaN1]-3-(hydroxy-kappaO)-2,7-naphthalenedisulfonato(7-)]]di-, hydrogen, compd. with 2,2'-iminobis[ethanol] (1:3:3)
CAS: 72906-64-0
CID: 175262
IUPAC 名称: dicopper;hydron;tris(2-(2-hydroxyethylamino)ethanol);3-oxido-4-[[2-oxido-4-[3-oxido-4-[(2-oxido-6-sulfonatonaphthalen-1-yl)diazenyl]phenyl]phenyl]diazenyl]naphthalene-2,7-disulfonate

分子属性

分子式: C44H51Cu2N7O19S3
分子量: 1205.2 g/mol
精确质量: 1203.09938 Da
单同位素质量: 1203.09938 Da
XLogP: 暂无
极性表面积: 496 Å²
氢键供体: 12
氢键受体: 26
可旋转键: 17
重原子数: 75
净电荷: 0
结构复杂度: 1640

结构标识

InChIKey: YJQWEHCEGAOYCV-UHFFFAOYSA-J
SMILES: [H+].[H+].[H+].C1=CC(=C(C=C1C2=CC(=C(C=C2)N=NC3=C4C=CC(=CC4=CC(=C3[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])[O-])[O-])N=NC5=C(C=CC6=C5C=CC(=C6)S(=O)(=O)[O-])[O-].C(CO)NCCO.C(CO)NCCO.C(CO)NCCO.[Cu+2].[Cu+2]
InChI: InChI=1S/C32H22N4O13S3.3C4H11NO2.2Cu/c37-26-10-3-18-11-20(50(41,42)43)4-6-22(18)30(26)35-33-24-8-1-16(13-27(24)38)17-2-9-25(28(39)14-17)34-36-31-23-7-5-21(51(44,45)46)12-19(23)15-29(32(31)40)52(47,48)49;3*6-3-1-5-2-4-7;;/h1-15,37-40H,(H,41,42,43)(H,44,45,46)(H,47,48,49);3*5-7H,1-4H2;;/q;;;;2*+2/p-4