Geometry & MOs

Info

ID:	410122
PubChem CID:	135082911
Reduced:	PO3F6H19C23 (1)
Stoich.:	AB3C6D19E23 (1)
Weight, g/mol:	488.05408
ΔH_f, kcal/mol:	-399.08
Dipole, Da:	11.89
IP(EA), eV:	-9.91(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[bromo(triphenyl)-lambda5-phosphanyl]-3-phenylprop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P(CC(C(F)(F)F)O)(C2=CC=CC=C2)(C3=CC=CC=C3)OC(=O)C(F)(F)F

DOS

IR

Vibrations