Geometry & MOs

Info

ID:	181587
PubChem CID:	76764207
Reduced:	ClOC13H17 (1)
Stoich.:	ABC13D17 (1)
Weight, g/mol:	395.85837
ΔH_f, kcal/mol:	-41.02
Dipole, Da:	1.97
IP(EA), eV:	-9.63(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4,5-trichloro-2-[(2R)-3-iodo-2-methoxypropyl]cyclopent-4-ene-1,3-dione

Drug info:

PubChemData

Smile

C[C@](/C=C/CCCCl)(C1=CC=CC=C1)O

DOS

IR

Vibrations