Geometry & MOs

Info

ID:	257340
PubChem CID:	103145367
Reduced:	NOC5H7 (3)
Stoich.:	ABC5D7 (3)
Weight, g/mol:	267.121906
ΔH_f, kcal/mol:	-61.11
Dipole, Da:	9.71
IP(EA), eV:	-9.34(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1[N+](=O)[O-])C)NC(=O)C2CCCC2CN

DOS

IR

Vibrations