Geometry & MOs

Info

ID:	269710
PubChem CID:	103618726
Reduced:	ClNF3O3H9C13 (1)
Stoich.:	ABC3D3E9F13 (1)
Weight, g/mol:	301.0717
ΔH_f, kcal/mol:	-223.43
Dipole, Da:	2.73
IP(EA), eV:	-8.95(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-chloro-2-[[2-(2-methoxyethoxy)acetyl]amino]benzoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)NC(=O)C2=CC=C(O2)Cl)C(F)(F)F

DOS

IR

Vibrations