Geometry & MOs

Info

ID:	393673
PubChem CID:	135021461
Reduced:	N2O5H14C21 (1)
Stoich.:	A2B5C14D21 (1)
Weight, g/mol:	392.08085
ΔH_f, kcal/mol:	-27.78
Dipole, Da:	6.26
IP(EA), eV:	-9.55(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(4-fluorophenyl)-2-oxoacetyl]phenyl]-4-nitrobenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(=O)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

DOS

IR

Vibrations