Geometry & MOs

Info

ID:	388336
PubChem CID:	134988837
Reduced:	OS2Cl3H5C8 (1)
Stoich.:	AB2C3D5E8 (1)
Weight, g/mol:	232.122832
ΔH_f, kcal/mol:	3.77
Dipole, Da:	4.3
IP(EA), eV:	-9.18(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-diethoxyphosphoryl-4-methylhexa-1,3-diene

Drug info:

PubChemData

Smile

CS/C(=C\1/C(=CC(=O)C(=C1Cl)Cl)Cl)/S

DOS

IR

Vibrations