Geometry & MOs

Info

ID:	29906
PubChem CID:	838140
Reduced:	ClN2O2C15H21 (1)
Stoich.:	AB2C2D15E21 (1)
Weight, g/mol:	334.088434
ΔH_f, kcal/mol:	-106.67
Dipole, Da:	5.05
IP(EA), eV:	-9.21(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(butanoylamino)-4-chloro-N-(4-fluorophenyl)benzamide

Drug info:

PubChemData

Smile

CCCC(=O)NC1=C(C=CC(=C1)C(=O)NCC(C)C)Cl

DOS

IR

Vibrations