Geometry & MOs

Info

ID:	369559
PubChem CID:	127334614
Reduced:	ON7C20H29 (1)
Stoich.:	AB7C20D29 (1)
Weight, g/mol:	367.146681
ΔH_f, kcal/mol:	21.28
Dipole, Da:	4.27
IP(EA), eV:	-8.9(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethyl-N-(1-pyridazin-3-ylpiperidin-3-yl)thieno[2,3-b]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCC(CC2)C(=O)NC3CCCN(C3)C4=NN=CC=C4

DOS

IR

Vibrations