Geometry & MOs

Info

ID:

440415

PubChem CID:

135230392

Reduced:

SN5C17H21 (1)

Stoich.:

AB5C17D21 (1)

Weight, g/mol:

618.251458

ΔHf, kcal/mol:

104.72

Dipole, Da:

3.7

IP(EA), eV:

 -8.24(-0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CNC(=C)N(CSCC1=NC(=CC=C1)N)C2=CC=CC=C2N=C

DOS

IR

Vibrations