Geometry & MOs

Info

ID:	264288
PubChem CID:	103450673
Reduced:	OC7H12 (2)
Stoich.:	AB7C12 (2)
Weight, g/mol:	238.102751
ΔH_f, kcal/mol:	-131.75
Dipole, Da:	2.73
IP(EA), eV:	-9.81(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-hydroxy-4-methylcyclohexyl)-(2-methylthiophen-3-yl)methanone

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C(=O)CC2CCCC2)O

DOS

IR

Vibrations