Geometry & MOs

Info

ID:	365080
PubChem CID:	127316822
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	265.179027
ΔH_f, kcal/mol:	-61.24
Dipole, Da:	5.63
IP(EA), eV:	-8.64(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-oxoethyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=C(C4=C(S3)N=C5CCCN5C4=O)C

DOS

IR

Vibrations