Geometry & MOs

Info

ID:	371828
PubChem CID:	131273743
Reduced:	ClON2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	235.046713
ΔH_f, kcal/mol:	-19.12
Dipole, Da:	3.67
IP(EA), eV:	-8.53(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-amino-5-(4-fluorophenyl)thiophen-3-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=C(C2=C1C=CC(=C2)Cl)C(CO)N

DOS

IR

Vibrations