Geometry & MOs

Info

ID:	151242
PubChem CID:	53790942
Reduced:	NF2O2H9C14 (1)
Stoich.:	AB2C2D9E14 (1)
Weight, g/mol:	252.112661
ΔH_f, kcal/mol:	-85.16
Dipole, Da:	4.07
IP(EA), eV:	-9.37(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dimethylpentan-3-yl(ethoxycarbonyloxy)phosphinic acid

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)OC2=CC=C(C=C2)F)F)C(C#N)O

DOS

IR

Vibrations