Geometry & MOs

Info

ID:	226219
PubChem CID:	87350172
Reduced:	ZnP2O8C24H52 (1)
Stoich.:	AB2C8D24E52 (1)
Weight, g/mol:	565.003275
ΔH_f, kcal/mol:	-458.12
Dipole, Da:	47.2
IP(EA), eV:	-7.43(-4.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloropyridin-4-yl)-2-[1-[(2,4-dichlorophenyl)methyl]-5-methoxy-2-methylsulfonylindol-3-yl]-2-oxoacetamide

Drug info:

PubChemData

Smile

CCCCC(C)OP(=O)([O-])OC(C)CCCC.CCCCC(C)OP(=O)([O-])OC(C)CCCC.[Zn+2]

DOS

IR

Vibrations