Geometry & MOs

Info

ID:

313360

PubChem CID:

126614073

Reduced:

O2N4C27H28 (1)

Stoich.:

A2B4C27D28 (1)

Weight, g/mol:

1088.488414

ΔHf, kcal/mol:

13.01

Dipole, Da:

3.97

IP(EA), eV:

 -8.24(-0.67)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-yl)-7-[4-(2-fluoroethyl)piperazin-1-yl]imidazo[1,2-a]pyridine;2-(1,3-benzodioxol-5-yl)-7-(4-fluoropiperidin-1-yl)imidazo[1,2-a]pyridine;2-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-[4-(2-fluoroethyl)piperidin-1-yl]imidazo[1,2-a]pyridine

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC2=NC(=CC=C2)C3=CC=CC=C3)C)OC(=O)NCC4=CC=C(C=C4)CN

DOS

IR

Vibrations