Geometry & MOs

Info

ID:

446013

PubChem CID:

135271511

Reduced:

FN3O3C19H22 (1)

Stoich.:

AB3C3D19E22 (1)

Weight, g/mol:

516.228517

ΔHf, kcal/mol:

-148.56

Dipole, Da:

8.65

IP(EA), eV:

 -8.89(-0.72)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-fluoro-10-(piperidine-1-carbonyl)-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraen-3-yl]-N-(2-imidazo[1,2-a]pyridin-3-yl-2-oxoethyl)acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)N2CCN3C=C(C4=CC(=CC(=C43)C2)F)CC(=O)O

DOS

IR

Vibrations