Geometry & MOs

Info

ID:	448931
PubChem CID:	135294562
Reduced:	N2C5H11 (2)
Stoich.:	A2B5C11 (2)
Weight, g/mol:	239.098
ΔH_f, kcal/mol:	8.56
Dipole, Da:	2.89
IP(EA), eV:	-8.34(2.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5,7-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-2-carboxylate

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CC(CN2C)N

DOS

IR

Vibrations