Geometry & MOs

Info

ID:	245727
PubChem CID:	103023135
Reduced:	SO2C11H16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	200.17763
ΔH_f, kcal/mol:	-76.57
Dipole, Da:	3.25
IP(EA), eV:	-9.04(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-2,6-dimethylnonan-4-one

Drug info:

PubChemData

Smile

CC(C)(CC(=O)CC1=CSC=C1)OC

DOS

IR

Vibrations