Geometry & MOs

Info

ID:	287437
PubChem CID:	104242266
Reduced:	NOSC12H19 (1)
Stoich.:	ABCD12E19 (1)
Weight, g/mol:	224.214016
ΔH_f, kcal/mol:	-51.37
Dipole, Da:	2.17
IP(EA), eV:	-9.21(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-2-(3,4-dimethylcyclohexyl)ethanol

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCC(C2CCCC2)O

DOS

IR

Vibrations