Geometry & MOs

Info

ID:	264292
PubChem CID:	103450839
Reduced:	OC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	295.1606
ΔH_f, kcal/mol:	-121.16
Dipole, Da:	2.75
IP(EA), eV:	-9.79(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(1-hydroxy-4-methylcyclohexyl)ethanone

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C(=O)CC2CC3CCC2C3)O

DOS

IR

Vibrations