Geometry & MOs

Info

ID:	226817
PubChem CID:	87558488
Reduced:	ClO3H5C9 (1)
Stoich.:	AB3C5D9 (1)
Weight, g/mol:	692.600135
ΔH_f, kcal/mol:	-64.98
Dipole, Da:	4.57
IP(EA), eV:	-10.21(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

octyl [trihexyl(tetradecyl)-lambda5-phosphanyl] hydrogen phosphate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C(=O)C(=O)Cl

DOS

IR

Vibrations