Geometry & MOs

Info

ID:	246794
PubChem CID:	103064996
Reduced:	SN2C14H28 (1)
Stoich.:	AB2C14D28 (1)
Weight, g/mol:	304.19732
ΔH_f, kcal/mol:	-34.2
Dipole, Da:	2.26
IP(EA), eV:	-8.34(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-2-phenyl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

CCC1CNC(CN1C2CCSC2)C(C)CC

DOS

IR

Vibrations