Geometry & MOs

Info

ID:	331027
PubChem CID:	127248434
Reduced:	SN3O4C23H27 (1)
Stoich.:	AB3C4D23E27 (1)
Weight, g/mol:	355.110296
ΔH_f, kcal/mol:	-90.98
Dipole, Da:	3.29
IP(EA), eV:	-8.6(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-3-(4-pyrimidin-2-ylmorpholin-2-yl)thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CCO)C(=O)C1=C(C2=C(S1)N=CC=C2)C3CN(CCO3)CC4=CC=C(C=C4)OC

DOS

IR

Vibrations