Geometry & MOs

Info

ID:	362673
PubChem CID:	127309062
Reduced:	ON3C10H18 (2)
Stoich.:	AB3C10D18 (2)
Weight, g/mol:	280.226312
ΔH_f, kcal/mol:	-49.39
Dipole, Da:	4.5
IP(EA), eV:	-8.45(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCCC(C1)(CNC(=O)N2CCN(CC2)C(C)C3=NC(=NO3)C)N(C)C

DOS

IR

Vibrations