Geometry & MOs

Info

ID:	222366
PubChem CID:	85297275
Reduced:	FN2O7C19H25 (1)
Stoich.:	AB2C7D19E25 (1)
Weight, g/mol:	412.147332
ΔH_f, kcal/mol:	-353.39
Dipole, Da:	4.76
IP(EA), eV:	-9.07(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(diethoxyphosphinothioylmethyl)-5-prop-2-enyloxolan-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

CC(=O)NC1C(C(C(OC1OC)CF)O)OC(=O)CC2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations