Geometry & MOs

Info

ID:	283001
PubChem CID:	103952511
Reduced:	O3N4C12H16 (1)
Stoich.:	A3B4C12D16 (1)
Weight, g/mol:	202.085461
ΔH_f, kcal/mol:	-109.84
Dipole, Da:	2.67
IP(EA), eV:	-9.71(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-oxopyrrolidin-3-yl)amino]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C(N=C1C)NC2CC(=O)NC2

DOS

IR

Vibrations