Geometry & MOs

Info

ID:

318498

PubChem CID:

126651539

Reduced:

FSN4O5C21H25 (1)

Stoich.:

ABC4D5E21F25 (1)

Weight, g/mol:

500.209341

ΔHf, kcal/mol:

-96.5

Dipole, Da:

9.17

IP(EA), eV:

 -8.92(-0.6)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-4-[6-[4-(1-cyclohexylazetidin-3-yl)buta-1,3-diynyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide

Drug info:

PubChemData

Smile

CC(CCN1CC2=CC(=CN2C1=O)C#CC#C[C@@]3(CCN(C3)C)F)(C(=O)NO)S(=O)(=O)C

DOS

IR

Vibrations