Geometry & MOs

Info

ID:	29915
PubChem CID:	838196
Reduced:	ClON2C15H15 (1)
Stoich.:	ABC2D15E15 (1)
Weight, g/mol:	343.141973
ΔH_f, kcal/mol:	-18.47
Dipole, Da:	5.88
IP(EA), eV:	-8.72(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxybenzoate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)C2=CC(=C(C=C2)Cl)N)C

DOS

IR

Vibrations