Geometry & MOs

Info

ID:

190536

PubChem CID:

78016655

Reduced:

FO3N13C33H44 (1)

Stoich.:

AB3C13D33E44 (1)

Weight, g/mol:

789.233247

ΔHf, kcal/mol:

8.05

Dipole, Da:

6.82

IP(EA), eV:

 -8.58(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[4-[[3-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yloxycarbonylamino)-2-oxo-4-[4-(phenylmethoxycarbonylamino)phenyl]butyl]-(2-methylpropyl)sulfamoyl]phenoxy]methylphosphonic acid

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCCNC(=O)C2CC(NN2)C3=NC=C(C4=C3NC=C4C(=O)C(=O)N5CCN(CC5)C(=NN)N(C6=CC=CC=C6)N=C)F

DOS

IR

Vibrations