Geometry & MOs

Info

ID:	3321
PubChem CID:	9498
Reduced:	N3O3C12H13 (1)
Stoich.:	A3B3C12D13 (1)
Weight, g/mol:	247.095691
ΔH_f, kcal/mol:	-3.97
Dipole, Da:	7.79
IP(EA), eV:	-9.68(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopentylideneamino)-4-nitrobenzamide

Drug info:

PubChemData

Smile

C1CCC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C1

DOS

IR

Vibrations