产品名称 | 5,10,15,20-四-(2,6-二氯苯基)-卟啉-铜(II) |
IUPAC名称 | copper;4-[10,15,20-tris(4-sulfophenyl)porphyrin-22,24-diid-5-yl]benzenesulfonic acid |
分子结构 | |
CAS注册号 | 56047-84-8 |
EINECS号码 | 数据不详 |
MDL号码 | MFCD03425949 |
Beilstein登记号码 | 数据不详 |
同义词 | 5,10,15,20-四(4-磺基苯基)-21h,23h-卟啉铜(ii); CU(II) 内消旋四(4-磺基苯基)卟啉; 铜;4-[10,15,20-三(4-磺苯基)卟啉-22,24-diid-5-yl]苯磺酸; 铜;4-[10,15,20-tris(4-sulfophenyl)-5-porphyrin-22,24-diidyl]苯磺酸; 铜;4-[10,15,20-三(4-磺苯基)卟啉-22,24-diid-5-yl]苯磺酸 |
分子式 | C44H28铜4O12S4 |
分子量 | 996.519 |
INCHI | InChI=1S/C44H28N4O12S4.Cu/c49-61(50,51)29-9-1-25(2-10-29)41-33-17-19-35(45-33)42(26-3-11-30(12-4-26)62(52,53)54)37-21-23-39(47-37)44(28-7-15-32(16-8-28)64(58,59)60)40-24-22-38(48-40)43(36-20-18-34(41)46-36)27-5-13-31(14-6-27)63(55,56)57;/h1-24H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60);/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-; |
InChI键 | FBYAOHXWXCVHGH-DAJBKUBHSA-N |
典范 SMILES | c1c(ccc(c1)S(=O)(=O)O)/c/2c\3/nc(/c(c/4\n5/c(c(\c6n/c(c(\c7n(c2cc7)[Cu]5)/c8ccc(cc8)S(=O)(=O)O)/C=C6)/c9ccc(cc9)S(=O)(=O)O)/cc4)/c1ccc(cc1)S(=O)(=O)O)C=C3 |