Geometry & MOs

Info

ID:	403955
PubChem CID:	135063327
Reduced:	O3C16H24 (1)
Stoich.:	A3B16C24 (1)
Weight, g/mol:	308.021653
ΔH_f, kcal/mol:	-139.8
Dipole, Da:	2.57
IP(EA), eV:	-8.81(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(4-chlorophenyl)-2-dimethoxyphosphoryl-2-hydroxyacetate

Drug info:

PubChemData

Smile

CC1=CCC(=CC=C1OC(=O)C(C)(C)C)C(C)(C)O

DOS

IR

Vibrations