Geometry & MOs

Info

ID:	406483
PubChem CID:	135077803
Reduced:	SN5C15H15 (1)
Stoich.:	AB5C15D15 (1)
Weight, g/mol:	373.136117
ΔH_f, kcal/mol:	92.66
Dipole, Da:	5.59
IP(EA), eV:	-8.56(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-6-(4-benzylpiperidin-1-yl)thieno[2,3-b]pyridine-2,5-dicarbonitrile

Drug info:

PubChemData

Smile

CC1CCN(CC1)C2=NC3=C(C=C2C#N)C(=C(S3)C#N)N

DOS

IR

Vibrations