Geometry & MOs

Info

ID:	204337
PubChem CID:	79950118
Reduced:	NOSC5H11 (2)
Stoich.:	ABCD5E11 (2)
Weight, g/mol:	269.192569
ΔH_f, kcal/mol:	-98.4
Dipole, Da:	5.54
IP(EA), eV:	-8.46(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-5-methylthiolan-3-yl]methanamine

Drug info:

PubChemData

Smile

CC1CC(CS1)(CN)N(C)CCS(=O)(=O)C

DOS

IR

Vibrations