Geometry & MOs

Info

ID:	246799
PubChem CID:	103065004
Reduced:	SN2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	288.16602
ΔH_f, kcal/mol:	18.47
Dipole, Da:	2.37
IP(EA), eV:	-8.47(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-2-phenyl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

CC1CNC(CN1C2CCSC2)C3=CC=CC=C3

DOS

IR

Vibrations