Geometry & MOs

Info

ID:	197770
PubChem CID:	78994385
Reduced:	FON3H10C11 (1)
Stoich.:	ABC3D10E11 (1)
Weight, g/mol:	212.152478
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	3.29
IP(EA), eV:	-9.58(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-(2-methylbutan-2-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)(C#N)C(=O)NC2=NC=C(C=C2)F

DOS

IR

Vibrations