Geometry & MOs

Info

ID:	268788
PubChem CID:	103600913
Reduced:	SO3C12H16 (1)
Stoich.:	AB3C12D16 (1)
Weight, g/mol:	323.047984
ΔH_f, kcal/mol:	-123.91
Dipole, Da:	2.69
IP(EA), eV:	-9.21(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(2,3-dichloroanilino)-2-phenylacetate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=CC=CC=C1)SCCO

DOS

IR

Vibrations