Geometry & MOs

Info

ID:	5620
PubChem CID:	13405
Reduced:	ClOH7C8 (1)
Stoich.:	ABC7D8 (1)
Weight, g/mol:	154.018542
ΔH_f, kcal/mol:	-32.72
Dipole, Da:	5.56
IP(EA), eV:	-10.15(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylbenzoyl chloride

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)Cl

DOS

IR

Vibrations