Geometry & MOs

Info

ID:	331024
PubChem CID:	127248431
Reduced:	FSN3O3C23H24 (1)
Stoich.:	ABC3D3E23F24 (1)
Weight, g/mol:	362.141262
ΔH_f, kcal/mol:	-91.09
Dipole, Da:	6.2
IP(EA), eV:	-9.05(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[2-(dimethylamino)-2-oxoethyl]morpholin-2-yl]-N-methylthieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1COCCN1C(=O)C2=C(C3=C(S2)N=CC=C3)C4CN(CCO4)CC5=CC=C(C=C5)F

DOS

IR

Vibrations