Geometry & MOs

Info

ID:

218262

PubChem CID:

85089102

Reduced:

NO4C28H29 (1)

Stoich.:

AB4C28D29 (1)

Weight, g/mol:

443.097349

ΔHf, kcal/mol:

-96.94

Dipole, Da:

6.16

IP(EA), eV:

 -8.98(-0.62)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-(1-hydroxyethyl)-4-methyl-3-[(6-methyl-[1,3]thiazolo[3,2-a]benzimidazol-1-yl)methylsulfanyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C(=O)N(CC1=CC=C(C=C1)C2=CC(=CC=C2)OC)C3=CC=CC(=C3)C=CC(=O)OC

DOS

IR

Vibrations