Geometry & MOs

Info

ID:	67055
PubChem CID:	46505776
Reduced:	FOC17H19 (1)
Stoich.:	ABC17D19 (1)
Weight, g/mol:	274.112443
ΔH_f, kcal/mol:	-72.37
Dipole, Da:	3.33
IP(EA), eV:	-9.83(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-2-[(2-chlorophenyl)methylidene]-5-cyclopentylcyclopentan-1-one

Drug info:

PubChemData

Smile

C1CCC(C1)C2CC/C(=C\C3=CC(=CC=C3)F)/C2=O

DOS

IR

Vibrations