Geometry & MOs

Info

ID:

440547

PubChem CID:

135230544

Reduced:

F2O3N9C29H29 (1)

Stoich.:

A2B3C9D29E29 (1)

Weight, g/mol:

607.235473

ΔHf, kcal/mol:

-17.88

Dipole, Da:

5.75

IP(EA), eV:

 -9.0(-0.99)

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]-4-methyl-1-phenylpyrazol-3-yl]-N-methoxypyridine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CN=C3C(=C2)C=NN3C)C4=CC=C(C=C4)F)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations