Geometry & MOs

Info

ID:	204265
PubChem CID:	79938600
Reduced:	SN3C12H23 (1)
Stoich.:	AB3C12D23 (1)
Weight, g/mol:	284.167083
ΔH_f, kcal/mol:	-3.19
Dipole, Da:	3.77
IP(EA), eV:	-8.56(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-(3-amino-3-sulfanylidenepropyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CCC(C(=S)N)N1CC2CCCN2CC1C

DOS

IR

Vibrations