Geometry & MOs

Info

ID:	28204
PubChem CID:	826265
Reduced:	ClON2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	194.02469
ΔH_f, kcal/mol:	-11.58
Dipole, Da:	2.57
IP(EA), eV:	-9.14(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2-cyanophenyl)acetamide

Drug info:

PubChemData

Smile

CCOC1=NC(=NC2=C1C=C(C=C2)Cl)C

DOS

IR

Vibrations