Geometry & MOs

Info

ID:

437441

PubChem CID:

135226304

Reduced:

F2O4N7C32H33 (1)

Stoich.:

A2B4C7D32E33 (1)

Weight, g/mol:

578.208924

ΔHf, kcal/mol:

-115.11

Dipole, Da:

7.96

IP(EA), eV:

 -8.71(-0.79)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[5-[[(4R,5S)-5-(3,4-difluorophenyl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]pyridine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(N=C2)N(N(C3=O)C)C)C4=CC=CC=C4)NC(=O)N[C@@H]5C[C@H](O[C@H]5C6=CC(=C(C=C6)F)F)CCOC

DOS

IR

Vibrations