Geometry & MOs

Info

ID:

214724

PubChem CID:

85083485

Reduced:

SF2O3N10C25H28 (1)

Stoich.:

AB2C3D10E25F28 (1)

Weight, g/mol:

586.177372

ΔHf, kcal/mol:

-35.37

Dipole, Da:

9.46

IP(EA), eV:

 -9.38(-1.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

benzhydryl 4-methylidene-5,8-dioxo-7-[(2-phenoxyacetyl)amino]-3-propan-2-yloxy-5lambda4-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N(C(=S)NC3=CC=C(C=C3)N4C=NN=N4)NC(=O)OC(C)(C)C

DOS

IR

Vibrations