Geometry & MOs

Info

ID:	265062
PubChem CID:	103508885
Reduced:	SO2N4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	291.140533
ΔH_f, kcal/mol:	-45.79
Dipole, Da:	6.91
IP(EA), eV:	-8.31(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-(3-ethylpiperidin-1-yl)-5-propanoylthiophene-3-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=C(C(=C(S1)N2CCC(CC2)OC)C#N)N

DOS

IR

Vibrations