Geometry & MOs

Info

ID:

134353

PubChem CID:

51684615

Reduced:

FO2N3C19H20 (1)

Stoich.:

AB2C3D19E20 (1)

Weight, g/mol:

442.22162

ΔHf, kcal/mol:

-97.13

Dipole, Da:

4.83

IP(EA), eV:

 -8.58(-0.41)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(1S,5S,6R,7R)-3-[(2R)-1-(cyclopentylamino)-1-oxopentan-2-yl]-N-(5-methyl-1,2-oxazol-3-yl)-4-oxo-10-oxa-3-azatricyclo[5.2.1.01,5]dec-8-ene-6-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)[C@@H]2CCCN2C(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations