Geometry & MOs

Info

ID:	412870
PubChem CID:	135085799
Reduced:	OCl3C7H9 (1)
Stoich.:	AB3C7D9 (1)
Weight, g/mol:	304.03241
ΔH_f, kcal/mol:	-58.51
Dipole, Da:	4.45
IP(EA), eV:	-10.58(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-5-iodo-1-[(5R)-5-methylcyclopenten-1-yl]hex-4-en-1-one

Drug info:

PubChemData

Smile

CCC/C=C/C(=O)C(Cl)(Cl)Cl

DOS

IR

Vibrations