Geometry & MOs

Info

ID:

440538

PubChem CID:

135230524

Reduced:

F2N5O5C27H33 (1)

Stoich.:

A2B5C5D27E33 (1)

Weight, g/mol:

709.283566

ΔHf, kcal/mol:

-198.89

Dipole, Da:

9.93

IP(EA), eV:

 -8.65(-0.55)

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]-1-(4-fluorophenyl)-4-methylpyrazol-3-yl]-2-methoxy-N-(oxan-4-yl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1OCC(C)(C)O)C2=CC=CC=C2)NC(=O)N[C@@H]3CN(O[C@H]3C4=CC(=C(C=C4)F)F)CCOC

DOS

IR

Vibrations