Geometry & MOs

Info

ID:	27931
PubChem CID:	824190
Reduced:	N3O3H15C16 (1)
Stoich.:	A3B3C15D16 (1)
Weight, g/mol:	247.095691
ΔH_f, kcal/mol:	21.33
Dipole, Da:	4.84
IP(EA), eV:	-9.4(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopentylideneamino)-2-nitrobenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=NNC(=O)C2=CC=CC=C2[N+](=O)[O-])C

DOS

IR

Vibrations