Geometry & MOs

Info

ID:	257337
PubChem CID:	103145357
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	251.126991
ΔH_f, kcal/mol:	-56.67
Dipole, Da:	7.0
IP(EA), eV:	-9.52(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethyl-4-nitrophenyl)-2-(ethylamino)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NC(=O)CNC2CCCC2

DOS

IR

Vibrations