Geometry & MOs

Info

ID:	8535
PubChem CID:	78952
Reduced:	PO3C24H51 (1)
Stoich.:	AB3C24D51 (1)
Weight, g/mol:	418.357582
ΔH_f, kcal/mol:	-294.08
Dipole, Da:	1.27
IP(EA), eV:	-10.28(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-ethylhexoxy(2-ethylhexyl)phosphoryl]oxymethyl]heptane

Drug info:

PubChemData

Smile

CCCCC(CC)COP(=O)(CC(CC)CCCC)OCC(CC)CCCC

DOS

IR

Vibrations