Geometry & MOs

Info

ID:	130506
PubChem CID:	51090985
Reduced:	NOC6H9 (3)
Stoich.:	ABC6D9 (3)
Weight, g/mol:	331.114376
ΔH_f, kcal/mol:	-51.98
Dipole, Da:	6.74
IP(EA), eV:	-8.81(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-6-(trifluoromethyl)-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCC(CC2)CN(C)C(C)C

DOS

IR

Vibrations