Geometry & MOs

Info

ID:	232872
PubChem CID:	87577327
Reduced:	SN3O6H23C25 (1)
Stoich.:	AB3C6D23E25 (1)
Weight, g/mol:	228.245316
ΔH_f, kcal/mol:	-169.5
Dipole, Da:	3.27
IP(EA), eV:	-9.05(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxytridecane

Drug info:

PubChemData

Smile

CC1=C(C(=C(N1)/C=C/2\C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CC=C4)NC2=O)CCC(=O)O)C(=O)C

DOS

IR

Vibrations