Geometry & MOs

Info

ID:	24200
PubChem CID:	608415
Reduced:	OPH19C20 (1)
Stoich.:	ABC19D20 (1)
Weight, g/mol:	306.117352
ΔH_f, kcal/mol:	-11.07
Dipole, Da:	4.33
IP(EA), eV:	-8.81(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(diphenylphosphorylmethyl)-4-methylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations