Geometry & MOs

Info

ID:	23255
PubChem CID:	602929
Reduced:	N3O5H7C8 (1)
Stoich.:	A3B5C7D8 (1)
Weight, g/mol:	225.03857
ΔH_f, kcal/mol:	-30.34
Dipole, Da:	2.12
IP(EA), eV:	-10.27(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dinitrophenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=CC=C1[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations