Geometry & MOs

Info

ID:	365443
PubChem CID:	127317842
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-94.07
Dipole, Da:	2.97
IP(EA), eV:	-8.56(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=CC2=C1OC(=C2)C(C)NC(=O)N3CC4CCCN4CC3C

DOS

IR

Vibrations