Geometry & MOs

Info

ID:

328228

PubChem CID:

126700131

Reduced:

SO5N6H26C30 (1)

Stoich.:

AB5C6D26E30 (1)

Weight, g/mol:

471.111359

ΔHf, kcal/mol:

-6.69

Dipole, Da:

1.96

IP(EA), eV:

 -8.26(-1.3)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-[[6-methoxy-2-(2-methylimidazo[1,2-b][1,2,4]triazin-6-yl)-1-benzofuran-4-yl]oxymethyl]-2-pyrazin-2-yl-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=NN2C=C(N=C2N=C1)C3=CC4=C(O3)C=C(C=C4OCC5=CSC(=N5)C6=CC=C(C=C6)C(=O)N7CCC(C7)O)OC

DOS

IR

Vibrations