Geometry & MOs

Info

ID:

440406

PubChem CID:

135230383

Reduced:

FO5N7H28C29 (1)

Stoich.:

AB5C7D28E29 (1)

Weight, g/mol:

556.234665

ΔHf, kcal/mol:

-71.95

Dipole, Da:

15.08

IP(EA), eV:

 -9.5(-1.32)

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-7-yl-4-methyl-2-phenylpyrazol-3-yl)urea

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(C(=O)OC3)N=C2)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations