Geometry & MOs

Info

ID:	339221
PubChem CID:	127260600
Reduced:	O2C9H16 (1)
Stoich.:	A2B9C16 (1)
Weight, g/mol:	218.167065
ΔH_f, kcal/mol:	-111.43
Dipole, Da:	2.57
IP(EA), eV:	-9.88(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z)-3-(2-cyclohexylideneethylidene)-4-methylidenecyclohexan-1-ol

Drug info:

PubChemData

Smile

CC1(CCC/C(=C\CO)/C1)O

DOS

IR

Vibrations