Geometry & MOs

Info

ID:	144716
PubChem CID:	53402806
Reduced:	ClFNOH7C8 (1)
Stoich.:	ABCDE7F8 (1)
Weight, g/mol:	183.045092
ΔH_f, kcal/mol:	-74.21
Dipole, Da:	4.78
IP(EA), eV:	-9.12(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-amino-2-chloro-3-methylphenyl)ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=C(C(=C(C=C1)N)F)Cl

DOS

IR

Vibrations