Geometry & MOs

Info

ID:	149638
PubChem CID:	53789312
Reduced:	OC9H9 (2)
Stoich.:	AB9C9 (2)
Weight, g/mol:	512.211647
ΔH_f, kcal/mol:	-36.22
Dipole, Da:	2.26
IP(EA), eV:	-9.36(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 2-benzyl-3-[benzyl(phenylmethoxy)phosphoryl]butanoate

Drug info:

PubChemData

Smile

C/C=C(/CC1=CC=CC=C1)\C(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations