Geometry & MOs

Info

ID:

441182

PubChem CID:

135233486

Reduced:

NO7C26H35 (1)

Stoich.:

AB7C26D35 (1)

Weight, g/mol:

426.237939

ΔHf, kcal/mol:

-283.74

Dipole, Da:

4.83

IP(EA), eV:

 -8.57(-0.91)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-(2,2-dimethylpropylamino)-6-[2-(1,3-oxazole-2-carbonyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-5-yl]pyridin-2-yl]-N-methylnitrous amide

Drug info:

PubChemData

Smile

CCCOCC1=CC=C(C1)C[C@H](C)C(=O)C2=C(C=C(OC2=O)C(C)CC/C=C/NC(=O)OC)O

DOS

IR

Vibrations