Geometry & MOs

Info

ID:	60763
PubChem CID:	26701968
Reduced:	NO9H17C19 (1)
Stoich.:	AB9C17D19 (1)
Weight, g/mol:	318.101585
ΔH_f, kcal/mol:	-242.95
Dipole, Da:	2.32
IP(EA), eV:	-9.95(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-N-(2-fluoro-4-methylphenyl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)C(=O)OC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)[N+](=O)[O-]

DOS

IR

Vibrations