Geometry & MOs

Info

ID:

15724

PubChem CID:

448021

Reduced:

P2N3F4O6H25C29 (1)

Stoich.:

A2B3C4D6E25F29 (1)

Weight, g/mol:

649.115472

ΔHf, kcal/mol:

-432.38

Dipole, Da:

5.91

IP(EA), eV:

 -9.49(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[[4-[2-(benzotriazol-1-yl)-3-[4-[difluoro(phosphono)methyl]phenyl]-2-phenylpropyl]phenyl]-difluoromethyl]phosphonic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(CC2=CC=C(C=C2)C(F)(F)P(=O)(O)O)(CC3=CC=C(C=C3)C(F)(F)P(=O)(O)O)N4C5=CC=CC=C5N=N4

DOS

IR

Vibrations