Geometry & MOs

Info

ID:	365525
PubChem CID:	127317973
Reduced:	O2N4C17H30 (1)
Stoich.:	A2B4C17D30 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-102.4
Dipole, Da:	6.19
IP(EA), eV:	-8.78(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,3-benzodioxol-5-yl)butan-2-yl]-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CCC(CC1)NC(=O)N2CCN(CC2)C3CCC3

DOS

IR

Vibrations