Geometry & MOs

Info

ID:

318429

PubChem CID:

126651355

Reduced:

BrNC6H8 (1)

Stoich.:

ABC6D8 (1)

Weight, g/mol:

988.382297

ΔHf, kcal/mol:

65.68

Dipole, Da:

2.52

IP(EA), eV:

-9.36(0.14)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2R)-4-[6-[4-(1-cyclopentylazetidin-3-yl)buta-1,3-diynyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]-N-hydroxy-2-methyl-2-methylsulfonylbutanamide;N-hydroxy-2-methyl-2-methylsulfonyl-4-[6-[4-[1-(oxan-4-yl)azetidin-3-yl]buta-1,3-diynyl]-3-oxo-1H-pyrrolo[1,2-c]imidazol-2-yl]butanamide

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](CN1)C#CBr

DOS

IR

Vibrations