Geometry & MOs

Info

ID:	365413
PubChem CID:	127317812
Reduced:	SN3O3C13H23 (1)
Stoich.:	AB3C3D13E23 (1)
Weight, g/mol:	239.199762
ΔH_f, kcal/mol:	-140.16
Dipole, Da:	4.73
IP(EA), eV:	-8.93(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations