Geometry & MOs

Info

ID:	271498
PubChem CID:	103681081
Reduced:	OCl2N2H14C16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	260.116092
ΔH_f, kcal/mol:	0.01
Dipole, Da:	5.66
IP(EA), eV:	-8.98(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-N-cyclopentyl-2,4-dihydroxybenzamide

Drug info:

PubChemData

Smile

CC1CCC2=CC=CC=C2N1C(=O)C3=C(N=C(C=C3)Cl)Cl

DOS

IR

Vibrations