Geometry & MOs

Info

ID:	272268
PubChem CID:	103737291
Reduced:	INOSC11H14 (1)
Stoich.:	ABCDE11F14 (1)
Weight, g/mol:	282.07712
ΔH_f, kcal/mol:	8.0
Dipole, Da:	3.52
IP(EA), eV:	-9.53(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(1-ethylcyclopropyl)methyl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

CCC1(CC1)CNC(=O)C2=CSC(=C2)I

DOS

IR

Vibrations