Geometry & MOs

Info

ID:	365527
PubChem CID:	127317975
Reduced:	SO2N3C15H27 (1)
Stoich.:	AB2C3D15E27 (1)
Weight, g/mol:	359.220892
ΔH_f, kcal/mol:	-129.92
Dipole, Da:	4.14
IP(EA), eV:	-8.51(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)CNC(=O)NCC2CCSCC2

DOS

IR

Vibrations