Geometry & MOs

Info

ID:	13128
PubChem CID:	221803
Reduced:	NOCl2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	245.037419
ΔH_f, kcal/mol:	-56.64
Dipole, Da:	3.55
IP(EA), eV:	-9.86(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-2,4-dichlorobenzamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations