Geometry & MOs

Info

ID:	23146
PubChem CID:	602430
Reduced:	NO2H9C13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	422.126657
ΔH_f, kcal/mol:	14.54
Dipole, Da:	7.04
IP(EA), eV:	-8.99(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-nitrophenyl)-N-(9H-xanthen-9-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)NC(=O)C4=CC=CC=C4C5=CC=C(C=C5)[N+](=O)[O-]

DOS

IR

Vibrations