Geometry & MOs

Info

ID:	36902
PubChem CID:	8014493
Reduced:	NO7H21C22 (1)
Stoich.:	AB7C21D22 (1)
Weight, g/mol:	393.077928
ΔH_f, kcal/mol:	-240.89
Dipole, Da:	5.11
IP(EA), eV:	-9.3(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[2-[2-(2-chloro-6-fluorophenyl)acetyl]oxyacetyl]amino]benzoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=CC=C(C=C2)C(=O)OC

DOS

IR

Vibrations