Geometry & MOs

Info

ID:	246787
PubChem CID:	103064948
Reduced:	SN2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	228.16602
ΔH_f, kcal/mol:	0.42
Dipole, Da:	2.35
IP(EA), eV:	-8.38(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-propyl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

CC1CNC(CN1C2CCSC2)(C)C3CC3

DOS

IR

Vibrations