Geometry & MOs

Info

ID:	27930
PubChem CID:	824187
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	297.111341
ΔH_f, kcal/mol:	-13.16
Dipole, Da:	6.12
IP(EA), eV:	-9.35(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methylphenyl)ethylideneamino]-2-nitrobenzamide

Drug info:

PubChemData

Smile

C[C@H]1CCCC(=NNC(=O)C2=CC=CC=C2[N+](=O)[O-])C1

DOS

IR

Vibrations