Geometry & MOs

Info

ID:	141907
PubChem CID:	52949738
Reduced:	SO2N5C21H23 (1)
Stoich.:	AB2C5D21E23 (1)
Weight, g/mol:	383.141596
ΔH_f, kcal/mol:	-34.96
Dipole, Da:	9.12
IP(EA), eV:	-8.63(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methoxypyridin-3-yl)-4-[[(3S)-piperidin-3-yl]amino]thieno[3,2-c]pyridine-7-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC(=C1)C2=CC3=C(S2)C(=CN=C3N[C@H]4CCCNC4)C(=O)N

DOS

IR

Vibrations