Geometry & MOs

Info

ID:

440544

PubChem CID:

135230541

Reduced:

O5N7C24H27 (1)

Stoich.:

A5B7C24D27 (1)

Weight, g/mol:

577.224909

ΔHf, kcal/mol:

-61.38

Dipole, Da:

10.01

IP(EA), eV:

 -8.91(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[5-[[(4R,5S)-5-(3,4-difluorophenyl)-2-methyl-1,2-oxazolidin-4-yl]carbamoylamino]-4-methyl-1-phenylpyrazol-3-yl]-N,1-dimethyl-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CC3=C(N=C2)N(C(=O)O3)C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(OC5)CCOC

DOS

IR

Vibrations