Geometry & MOs

Info

ID:

318490

PubChem CID:

126651517

Reduced:

SN4O5C23H28 (1)

Stoich.:

AB4C5D23E28 (1)

Weight, g/mol:

978.325176

ΔHf, kcal/mol:

-13.06

Dipole, Da:

6.5

IP(EA), eV:

 -8.82(-0.45)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2R)-4-[6-[4-[1-(dimethylamino)cyclopropyl]buta-1,3-diynyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide;[1-[4-[2-[4-(hydroxyamino)-3-methyl-3-methylsulfonyl-4-oxobutyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-6-yl]buta-1,3-diynyl]cyclopropyl]methyl 3-hydroxyazetidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@](CCN1CC2=CC(=CN2C1=O)C#CC#CC3CN(C3)CC4CC4)(C(=O)NO)S(=O)(=O)C

DOS

IR

Vibrations