Geometry & MOs

Info

ID:	142267
PubChem CID:	53007594
Reduced:	SO3N4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	398.141262
ΔH_f, kcal/mol:	-45.92
Dipole, Da:	1.5
IP(EA), eV:	-8.15(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethoxyphenyl)-1-([1,3]thiazolo[5,4-b]pyridin-2-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)C3=NC4=C(S3)N=CC=C4)OC

DOS

IR

Vibrations