Geometry & MOs

Info

ID:

437449

PubChem CID:

135226312

Reduced:

FO5N8C29H31 (1)

Stoich.:

AB5C8D29E31 (1)

Weight, g/mol:

608.230722

ΔHf, kcal/mol:

-55.66

Dipole, Da:

12.64

IP(EA), eV:

 -9.31(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[5-[[(4R,5S)-5-(5,6-difluoropyridin-3-yl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]-N-methoxypyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC(=NC=C2)C(=O)NOC)C3=CC=CC=C3)NC(=O)N[C@@H]4CN(O[C@H]4C5=CC(=NC=C5)F)CCOC

DOS

IR

Vibrations