Geometry & MOs

Info

ID:	264092
PubChem CID:	103427731
Reduced:	NCl2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	307.115462
ΔH_f, kcal/mol:	-82.69
Dipole, Da:	5.35
IP(EA), eV:	-8.78(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-ethyl-5-[2-(3-fluorophenyl)ethylamino]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCC(C(=O)OC)N1C=CC2=C1C=C(C=C2Cl)Cl

DOS

IR

Vibrations