Geometry & MOs

Info

ID:	2629
PubChem CID:	8093
Reduced:	OC8H16 (1)
Stoich.:	AB8C16 (1)
Weight, g/mol:	128.120115
ΔH_f, kcal/mol:	-77.84
Dipole, Da:	3.27
IP(EA), eV:	-10.12(0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octan-2-one

Drug info:

PubChemData

Smile

CCCCCCC(=O)C

DOS

IR

Vibrations