Geometry & MOs

Info

ID:

440640

PubChem CID:

135230690

Reduced:

FO5N8C33H37 (1)

Stoich.:

AB5C8D33E37 (1)

Weight, g/mol:

599.240479

ΔHf, kcal/mol:

-104.51

Dipole, Da:

11.38

IP(EA), eV:

 -9.25(-0.89)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CN=C1C(=O)N[C@@H]2CCOC2)C3=NN(C(=C3C)NC(=O)N[C@@H]4CN(O[C@H]4C5=CC(=NC=C5)F)CCOC)C6=CC=CC=C6

DOS

IR

Vibrations