Geometry & MOs

Info

ID:	337816
PubChem CID:	127258439
Reduced:	PO4C14H21 (1)
Stoich.:	AB4C14D21 (1)
Weight, g/mol:	346.133396
ΔH_f, kcal/mol:	-217.76
Dipole, Da:	4.33
IP(EA), eV:	-9.87(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(R)-[ethoxy(phenyl)phosphoryl]-phenylmethyl] butanoate

Drug info:

PubChemData

Smile

CCCC(=O)O[C@H](C)[P@](=O)(C1=CC=CC=C1)OCC

DOS

IR

Vibrations