Geometry & MOs

Info

ID:	175225
PubChem CID:	75869758
Reduced:	ClN4O4H15C17 (1)
Stoich.:	AB4C4D15E17 (1)
Weight, g/mol:	289.11365
ΔH_f, kcal/mol:	-51.92
Dipole, Da:	5.59
IP(EA), eV:	-9.07(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4-methoxyphenyl)ethyl]-N,5-dimethylthiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C2=CN=CC=C2)OC(=O)C3=CC(=C(C=C3OC)N)Cl

DOS

IR

Vibrations