Geometry & MOs

Info

ID:	215908
PubChem CID:	85085424
Reduced:	SO2C9H18 (1)
Stoich.:	AB2C9D18 (1)
Weight, g/mol:	191.094629
ΔH_f, kcal/mol:	-106.94
Dipole, Da:	3.06
IP(EA), eV:	-8.51(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-oxobutyl)-1-phenylmethanimine oxide

Drug info:

PubChemData

Smile

CC(C)C1C(CCS1)OCOC

DOS

IR

Vibrations