Geometry & MOs

Info

ID:	191439
PubChem CID:	78146202
Reduced:	N2O2H5C7F9 (1)
Stoich.:	A2B2C5D7E9 (1)
Weight, g/mol:	367.132077
ΔH_f, kcal/mol:	-501.02
Dipole, Da:	3.12
IP(EA), eV:	-11.17(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(4-nitrophenyl)-phenylmethylidene]amino]naphthalen-1-amine

Drug info:

PubChemData

Smile

CC=NOC(=O)NC(C(F)(F)F)(C(F)(F)F)C(F)(F)F

DOS

IR

Vibrations