Geometry & MOs

Info

ID:	274714
PubChem CID:	103811222
Reduced:	ClON3H10C16 (1)
Stoich.:	ABC3D10E16 (1)
Weight, g/mol:	259.05124
ΔH_f, kcal/mol:	54.7
Dipole, Da:	5.07
IP(EA), eV:	-9.59(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-cyanophenyl)-1-cyanocyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(=O)NC2=C(C=C(C=C2)C#N)Cl)C#N

DOS

IR

Vibrations