Geometry & MOs

Info

ID:	365499
PubChem CID:	127317924
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	308.221226
ΔH_f, kcal/mol:	22.23
Dipole, Da:	5.42
IP(EA), eV:	-8.53(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)NCC3=NN(C4=C3CCC4)C5=CC=CC=C5

DOS

IR

Vibrations