Geometry & MOs

Info

ID:	182961
PubChem CID:	76963919
Reduced:	KPC3O6H8 (1)
Stoich.:	ABC3D6E8 (1)
Weight, g/mol:	290.118591
ΔH_f, kcal/mol:	-378.44
Dipole, Da:	10.25
IP(EA), eV:	-9.74(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(4-chlorophenyl)-N,N-dimethyl-3-pyridin-2-ylpropan-1-amine oxide

Drug info:

PubChemData

Smile

C(C(CO)OP(=O)(O)[O-])O.[K+]

DOS

IR

Vibrations