Geometry & MOs

Info

ID:	6607
PubChem CID:	69219
Reduced:	ClOC4H7 (1)
Stoich.:	ABC4D7 (1)
Weight, g/mol:	106.018542
ΔH_f, kcal/mol:	-60.75
Dipole, Da:	1.4
IP(EA), eV:	-10.34(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chlorobutan-2-one

Drug info:

PubChemData

Smile

CCC(=O)CCl

DOS

IR

Vibrations