Geometry & MOs

Info

ID:	393373
PubChem CID:	135020344
Reduced:	O3C17H26 (1)
Stoich.:	A3B17C26 (1)
Weight, g/mol:	260.060407
ΔH_f, kcal/mol:	-155.53
Dipole, Da:	4.53
IP(EA), eV:	-9.73(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-(2-chlorophenyl)-3-cyclopenta-2,4-dien-1-ylidene-1-methoxyprop-1-en-1-ol

Drug info:

PubChemData

Smile

CCCCC1=C2CC3(CC2CC1=O)COC(OC3)(C)C

DOS

IR

Vibrations