Geometry & MOs

Info

ID:	329993
PubChem CID:	127246980
Reduced:	OSN4C15H18 (1)
Stoich.:	ABC4D15E18 (1)
Weight, g/mol:	313.153875
ΔH_f, kcal/mol:	18.9
Dipole, Da:	7.09
IP(EA), eV:	-8.74(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-5-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidine-1-carbonyl]pyridin-2-one

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N2CCCC2C3=CN=CC(=N3)NC

DOS

IR

Vibrations