Geometry & MOs

Info

ID:	53248
PubChem CID:	14709888
Reduced:	OSC9H16 (1)
Stoich.:	ABC9D16 (1)
Weight, g/mol:	288.154787
ΔH_f, kcal/mol:	-38.11
Dipole, Da:	2.4
IP(EA), eV:	-8.69(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-cyclohexyl-2-methylidene-3-methylsulfanyl-4-phenylbut-3-en-1-ol

Drug info:

PubChemData

Smile

CC(C)C(C(=C)C(=C)SC)O

DOS

IR

Vibrations