Geometry & MOs

Info

ID:	213024
PubChem CID:	81062548
Reduced:	N2O3C14H18 (1)
Stoich.:	A2B3C14D18 (1)
Weight, g/mol:	295.124215
ΔH_f, kcal/mol:	-48.71
Dipole, Da:	3.69
IP(EA), eV:	-9.54(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-5-(4-hydroxybut-1-ynyl)-N,4-dimethylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C1=C(C=NC=C1)C#CCO

DOS

IR

Vibrations