Geometry & MOs

Info

ID:	330969
PubChem CID:	127248376
Reduced:	SN2O2C9H12 (2)
Stoich.:	AB2C2D9E12 (2)
Weight, g/mol:	441.147075
ΔH_f, kcal/mol:	-105.69
Dipole, Da:	6.72
IP(EA), eV:	-9.04(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(2-aminopyridine-3-carbonyl)morpholin-2-yl]-N-(2-methoxyethyl)thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=C(C2=C(S1)N=CC=C2)C3CN(CCO3)S(=O)(=O)N4CCCC4

DOS

IR

Vibrations