Geometry & MOs

Info

ID:	413652
PubChem CID:	135086601
Reduced:	PO4H19C22 (1)
Stoich.:	AB4C19D22 (1)
Weight, g/mol:	392.117746
ΔH_f, kcal/mol:	-118.81
Dipole, Da:	4.54
IP(EA), eV:	-9.75(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-3-diphenylphosphoryloxy-3-(4-methylphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

COC(=O)/C=C(/C1=CC=CC=C1)\OP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations