Geometry & MOs

Info

ID:	246797
PubChem CID:	103065001
Reduced:	SN2C14H20 (1)
Stoich.:	AB2C14D20 (1)
Weight, g/mol:	228.16602
ΔH_f, kcal/mol:	28.06
Dipole, Da:	2.62
IP(EA), eV:	-8.6(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butyl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

C1CSCC1N2CCNCC2C3=CC=CC=C3

DOS

IR

Vibrations