51209-41-7
CUPRIC PICRATE X-HYDRATE
NameCUPRIC PICRATE X-HYDRATE
FormulaC12 H4 Cu N6 O14 . H2 O
1Identification
【Name】
CUPRIC PICRATE X-HYDRATE
【CAS】
【MDL】
MFCD00167191
【English Synonyms】
【Formula】
C12 H4 Cu N6 O14 . H2 O
【MolWeight】
537.752
【Inchi】
InChI=1S/2C6H3N3O7.Cu.H2O/c2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;;/h2*1-2,10H;;1H2/q;;+2;/p-2
【InChIKey】
InChIKey=RCYGNLIVAMDGPS-UHFFFAOYSA-L
【SMILES】
c1c(cc(c(c1[N+](=O)[O-])O[Cu]Oc2c(cc(cc2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].O
【MOL File】
CUPRIC PICRATE X-HYD….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:20
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CUPRIC PICRATE X-HYDRATE.cml