Geometry & MOs

Info

ID:	56758
PubChem CID:	22389445
Reduced:	SO2N4H16C17 (1)
Stoich.:	AB2C4D16E17 (1)
Weight, g/mol:	330.115047
ΔH_f, kcal/mol:	38.56
Dipole, Da:	6.79
IP(EA), eV:	-9.32(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.1]heptan-3-yl)-2-[formyl(methyl)amino]thieno[3,2-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C1CN2CC1C(C2)NC(=O)C3=NC=C4C(=C3)C(=CS4)C#CC(=O)N

DOS

IR

Vibrations