Geometry & MOs

Info

ID:	288030
PubChem CID:	104308876
Reduced:	ClFNOH7C9 (1)
Stoich.:	ABCDE7F9 (1)
Weight, g/mol:	224.035255
ΔH_f, kcal/mol:	-41.44
Dipole, Da:	2.58
IP(EA), eV:	-9.6(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloro-2-cyanoethoxy)benzamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations