Geometry & MOs

Info

ID:	338415
PubChem CID:	127259107
Reduced:	NO4C12H13 (1)
Stoich.:	AB4C12D13 (1)
Weight, g/mol:	239.05422
ΔH_f, kcal/mol:	-104.07
Dipole, Da:	4.5
IP(EA), eV:	-9.2(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(3-nitropyridin-2-yl)amino]-2-oxoethyl] acetate

Drug info:

PubChemData

Smile

CC1=NOC2=C1C=CC(=C2)OCCOC(=O)C

DOS

IR

Vibrations