Geometry & MOs

Info

ID:	264040
PubChem CID:	103420628
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	281.156184
ΔH_f, kcal/mol:	-58.98
Dipole, Da:	5.66
IP(EA), eV:	-8.43(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-5-(azocan-1-yl)-N-ethylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC(=O)C1=C(C(=C(S1)N2CCCCCCC2)C#N)N

DOS

IR

Vibrations