Geometry & MOs

Info

ID:	339213
PubChem CID:	127260592
Reduced:	O2C15H26 (1)
Stoich.:	A2B15C26 (1)
Weight, g/mol:	200.123486
ΔH_f, kcal/mol:	-118.14
Dipole, Da:	4.28
IP(EA), eV:	-9.1(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-(butylsulfanylmethylidene)cyclohexan-1-ol

Drug info:

PubChemData

Smile

C/C(=C\CO)/C=C/C1C(CCCC1(C)O)(C)C

DOS

IR

Vibrations