Geometry & MOs

Info

ID:	246791
PubChem CID:	103064990
Reduced:	SN2C12H22 (1)
Stoich.:	AB2C12D22 (1)
Weight, g/mol:	228.16602
ΔH_f, kcal/mol:	9.05
Dipole, Da:	1.97
IP(EA), eV:	-8.53(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-2,5-dimethyl-1-(thiolan-3-yl)piperazine

Drug info:

PubChemData

Smile

CC1(CN(CCN1)C2CCSC2)C3CC3

DOS

IR

Vibrations