Geometry & MOs

Info

ID:

318494

PubChem CID:

126651526

Reduced:

FSN4O5C24H27 (1)

Stoich.:

ABC4D5E24F27 (1)

Weight, g/mol:

488.152969

ΔHf, kcal/mol:

-105.79

Dipole, Da:

7.95

IP(EA), eV:

 -8.67(-0.46)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-4-[6-[2-[4-(3-fluoroazetidin-3-yl)phenyl]ethynyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide

Drug info:

PubChemData

Smile

C[C@@](CCN1CC2=CC(=CN2C1=O)C#CC3=CC=C(C=C3)CN4CC(C4)F)(C(=O)NO)S(=O)(=O)C

DOS

IR

Vibrations