Geometry & MOs

Info

ID:	405480
PubChem CID:	135074150
Reduced:	O3C20H20 (1)
Stoich.:	A3B20C20 (1)
Weight, g/mol:	234.198365
ΔH_f, kcal/mol:	-63.98
Dipole, Da:	5.14
IP(EA), eV:	-8.83(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-but-2-en-2-yl]-1-prop-2-enoxy-2-prop-1-en-2-ylcyclohexane

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1CC=C)O)C(=O)C2=CC=CC=C2)O)CC=C

DOS

IR

Vibrations