Geometry & MOs

Info

ID:	246924
PubChem CID:	103065624
Reduced:	SN3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	237.129969
ΔH_f, kcal/mol:	14.89
Dipole, Da:	2.6
IP(EA), eV:	-9.04(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[3-(thiolan-3-yl)imidazol-4-yl]piperidine

Drug info:

PubChemData

Smile

CC[C@H](C1=CN=CN1C2CCSC2)N

DOS

IR

Vibrations