Geometry & MOs

Info

ID:	404487
PubChem CID:	135066545
Reduced:	OC6H7 (2)
Stoich.:	AB6C7 (2)
Weight, g/mol:	433.99326
ΔH_f, kcal/mol:	-62.21
Dipole, Da:	5.35
IP(EA), eV:	-8.88(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(diphenylphosphoryloxymethyl)-4-iodobenzene

Drug info:

PubChemData

Smile

CC1=C(OC(=C1)C2=CC(=O)CCC2)C

DOS

IR

Vibrations