Geometry & MOs

Info

ID:	365222
PubChem CID:	127317070
Reduced:	N6C17H24 (1)
Stoich.:	A6B17C24 (1)
Weight, g/mol:	357.252861
ΔH_f, kcal/mol:	98.1
Dipole, Da:	5.24
IP(EA), eV:	-8.57(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-(6-piperidin-1-ylpyridin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1CCC3=NN=NN3C4=CC=CC=C4

DOS

IR

Vibrations