Geometry & MOs

Info

ID:

440487

PubChem CID:

135230473

Reduced:

FO4N8C29H33 (1)

Stoich.:

AB4C8D29E33 (1)

Weight, g/mol:

556.234665

ΔHf, kcal/mol:

-49.89

Dipole, Da:

9.98

IP(EA), eV:

 -8.98(-0.83)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[(4R,5S)-5-(2-fluoropyridin-4-yl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]-3-(5-imidazo[1,2-a]pyridin-6-yl-4-methyl-2-phenylpyrazol-3-yl)urea

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations