Geometry & MOs

Info

ID:

440593

PubChem CID:

135230590

Reduced:

FO3N10C28H29 (1)

Stoich.:

AB3C10D28E29 (1)

Weight, g/mol:

630.271444

ΔHf, kcal/mol:

53.45

Dipole, Da:

11.43

IP(EA), eV:

 -9.16(-0.95)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-cyclopropyl-5-[5-[[(4R,5S)-5-(2-fluoropyridin-4-yl)-2-(2-methoxyethyl)-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]-3-methoxypyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(N=C2)N(N=N3)C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations