Geometry & MOs

Info

ID:	83149
PubChem CID:	49857210
Reduced:	SO2N5C17H19 (1)
Stoich.:	AB2C5D17E19 (1)
Weight, g/mol:	371.141596
ΔH_f, kcal/mol:	-2.76
Dipole, Da:	5.3
IP(EA), eV:	-9.25(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[hydroxy(thiophen-2-yl)methyl]-N-[[(3S)-piperidin-3-yl]methyl]-1H-imidazo[4,5-b]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](CNC1)NC(=O)C2=C3C(=NC=C2)N=C(N3)C(C4=CC=CS4)O

DOS

IR

Vibrations