Geometry & MOs

Info

ID:	384383
PubChem CID:	134976883
Reduced:	BrOPH22C26 (1)
Stoich.:	ABCD22E26 (1)
Weight, g/mol:	408.149046
ΔH_f, kcal/mol:	52.78
Dipole, Da:	3.51
IP(EA), eV:	-8.78(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[acetyloxy(triphenyl)-lambda5-phosphanyl]propanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C=O)P(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)Br

DOS

IR

Vibrations