Geometry & MOs

Info

ID:	31926
PubChem CID:	3723586
Reduced:	ClFNH3C7 (1)
Stoich.:	ABCD3E7 (1)
Weight, g/mol:	287.062757
ΔH_f, kcal/mol:	2.15
Dipole, Da:	4.17
IP(EA), eV:	-10.13(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(4-fluorophenyl)sulfonylazetidine-3-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)Cl)C#N

DOS

IR

Vibrations