Geometry & MOs

Info

ID:	60718
PubChem CID:	26697498
Reduced:	ClNO3C20H22 (1)
Stoich.:	ABC3D20E22 (1)
Weight, g/mol:	277.142641
ΔH_f, kcal/mol:	-93.72
Dipole, Da:	5.47
IP(EA), eV:	-8.68(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-4-(ethylamino)-3-nitrobenzamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(=O)NC2CCCC2)OCC3=CC=CC=C3Cl

DOS

IR

Vibrations