Geometry & MOs

Info

ID:	22202
PubChem CID:	596258
Reduced:	N2O3C17H18 (1)
Stoich.:	A2B3C17D18 (1)
Weight, g/mol:	298.131742
ΔH_f, kcal/mol:	-14.62
Dipole, Da:	6.03
IP(EA), eV:	-9.58(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-ethyl-4-methyl-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

DOS

IR

Vibrations