Geometry & MOs

Info

ID:	330965
PubChem CID:	127248372
Reduced:	SN4O4C22H22 (1)
Stoich.:	AB4C4D22E22 (1)
Weight, g/mol:	432.183127
ΔH_f, kcal/mol:	-69.3
Dipole, Da:	6.86
IP(EA), eV:	-9.12(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(1-acetylpiperidin-4-yl)morpholin-2-yl]-N-(2-hydroxyethyl)thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C2=C(C3=C(S2)N=CC=C3)C4CN(CCO4)C(=O)C5=CC=CC=N5

DOS

IR

Vibrations