Geometry & MOs

Info

ID:	204313
PubChem CID:	79945492
Reduced:	N3C17H27 (1)
Stoich.:	A3B17C27 (1)
Weight, g/mol:	240.183778
ΔH_f, kcal/mol:	13.03
Dipole, Da:	3.87
IP(EA), eV:	-8.11(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)-2-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1CCNC3=CC=CC=C3C

DOS

IR

Vibrations