Geometry & MOs

Info

ID:	45097
PubChem CID:	10508002
Reduced:	FeOSSnC29H42 (1)
Stoich.:	ABCDE29F42 (1)
Weight, g/mol:	612.31544
ΔH_f, kcal/mol:	18.38
Dipole, Da:	5.23
IP(EA), eV:	-6.66(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromoethyl 22-(oxan-2-yloxy)docosyl hydrogen phosphate

Drug info:

PubChemData

Smile

CCCC[Sn+](CCCC)CCCC.CC1=CC=C(C=C1)[S@](=O)[C]2[CH][CH][CH][C-]2.[CH]1[CH][CH][CH][CH]1.[Fe+2]

DOS

IR

Vibrations