Geometry & MOs

Info

ID:

437448

PubChem CID:

135226311

Reduced:

F2O5N8C28H28 (1)

Stoich.:

A2B5C8D28E28 (1)

Weight, g/mol:

590.240144

ΔHf, kcal/mol:

-48.03

Dipole, Da:

7.86

IP(EA), eV:

 -7.52(-1.58)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[5-[[(4R,5S)-5-(2-fluoropyridin-4-yl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]-N-methoxypyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC\1=C(N(N/C1=C\2/C=CNC(=C2)C(=O)N=O)C3=CC=CC=C3)NC(=O)N[C@@H]4CN(O[C@H]4C5=CC(=C(N=C5)F)F)CCOC

DOS

IR

Vibrations