Geometry & MOs

Info

ID:	404320
PubChem CID:	135065888
Reduced:	PO3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	358.029237
ΔH_f, kcal/mol:	-184.18
Dipole, Da:	5.06
IP(EA), eV:	-8.7(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-(4-chlorophenoxy)phosphoryl]-4-chlorophenol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)OP(=O)(C2=C(C=C(C=C2O)C)C)C(C)(C)C)C

DOS

IR

Vibrations