Geometry & MOs

Info

ID:	384537
PubChem CID:	134977187
Reduced:	IOPC22H22 (1)
Stoich.:	ABCD22E22 (1)
Weight, g/mol:	476.121117
ΔH_f, kcal/mol:	35.82
Dipole, Da:	6.16
IP(EA), eV:	-7.94(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxoethyl(triphenyl)-lambda5-phosphanyl] 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

C1C(O1)CCP(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)I

DOS

IR

Vibrations