Geometry & MOs

Info

ID:

84290

PubChem CID:

49865275

Reduced:

ON6C20H24 (1)

Stoich.:

AB6C20D24 (1)

Weight, g/mol:

572.131188

ΔHf, kcal/mol:

54.48

Dipole, Da:

8.08

IP(EA), eV:

 -8.82(-0.81)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

(2Z)-2-[5-[(4-fluorophenyl)methyl]-3H-1,3-thiazol-2-ylidene]-9-(5-methyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)-7-morpholin-4-ylpyrido[1,2-a]pyrimidine-3,4-dione

Drug info:

PubChemData

Smile

CN(C)C1=NN2C(=NC=C2C3=CC=C(C=C3)C(=O)NC[C@@H]4CCCN4)C=C1

DOS

IR

Vibrations