52705-52-9
1,2,3-TRIAQUA-1,2:1,2:1,3:1,3:2,3:2,3-HEXA-M-ACETATO(O,O')-M3-OXO-TRIANGULO-TRIIRIDIUM ACETATE
Name
1,2,3-TRIAQUA-1,2:1,2:1,3:1,3:2,3:2,3-HEXA-M-ACETATO(O,O')-M3-OXO-TRIANGULO-TRIIRIDIUM ACETATE
Formula
C12 H18 Ir3 O15 . C2 H3 O2 . 3 H2 O
MolWeight
1092.01
1Identification
【Name】
1,2,3-TRIAQUA-1,2:1,2:1,3:1,3:2,3:2,3-HEXA-M-ACETATO(O,O')-M3-OXO-TRIANGULO-TRIIRIDIUM ACETATE
【CAS】
【MDL】
MFCD09953445
【English Synonyms】
【Formula】
C12 H18 Ir3 O15 . C2 H3 O2 . 3 H2 O
【MolWeight】
1092.01
【Inchi】
InChI=1S/7C2H4O2.3Ir.3H2O.3O/c7*1-2(3)4;;;;;;;;;/h7*1H3,(H,3,4);;;;3*1H2;;;/q;;;;;;;2*+2;+3;;;;;;/p-7
【InChIKey】
InChIKey=HAKWIFYUGZPPFE-UHFFFAOYSA-G
【SMILES】
CC(=O)[O-].CC(=O)O[Ir]1(O[Ir](O[Ir+](O1)(OC(=O)C)OC(=O)C)(OC(=O)C)OC(=O)C)OC(=O)C.O.O.O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:15
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,2,3-TRIAQUA-1,2:1,2:1,3:1,3:2,3:2,3-HEXA-M-ACETATO(O,O')-M3-OXO-TRIANGULO-TRIIRIDIUM ACETATE.cml
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