Geometry & MOs

Info

ID:	276179
PubChem CID:	103821087
Reduced:	ClON2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	278.062219
ΔH_f, kcal/mol:	-22.95
Dipole, Da:	4.19
IP(EA), eV:	-8.68(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(2-chloro-5-fluorophenyl)-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)Cl)NC(=O)C2=CC(=C(C=C2)N)C

DOS

IR

Vibrations