Geometry & MOs

Info

ID:	367674
PubChem CID:	127325222
Reduced:	ON4C20H26 (1)
Stoich.:	AB4C20D26 (1)
Weight, g/mol:	371.220892
ΔH_f, kcal/mol:	7.67
Dipole, Da:	3.67
IP(EA), eV:	-9.44(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)-6-(4-methoxyphenyl)-1-methylpiperidin-2-one

Drug info:

PubChemData

Smile

C1CCC(CC1)CC2CCCN2C(=O)C3=CC(=CC=C3)N4C=NC=N4

DOS

IR

Vibrations