Geometry & MOs

Info

ID:	203394
PubChem CID:	79824085
Reduced:	SN2C15H20 (1)
Stoich.:	AB2C15D20 (1)
Weight, g/mol:	193.056135
ΔH_f, kcal/mol:	41.29
Dipole, Da:	1.38
IP(EA), eV:	-8.96(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-thiazol-2-ylmethyl)cyclohex-2-en-1-one

Drug info:

PubChemData

Smile

CCNC(CCCC1=NC=CS1)C2=CC=CC=C2

DOS

IR

Vibrations