Geometry & MOs

Info

ID:	34155
PubChem CID:	7890095
Reduced:	NO2C5H5 (3)
Stoich.:	AB2C5D5 (3)
Weight, g/mol:	327.121906
ΔH_f, kcal/mol:	-121.69
Dipole, Da:	3.78
IP(EA), eV:	-8.72(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-nitro-2-oxopyridin-1-yl)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-])OC

DOS

IR

Vibrations