Geometry & MOs

Info

ID:	338434
PubChem CID:	127259126
Reduced:	SO4C12H14 (1)
Stoich.:	AB4C12D14 (1)
Weight, g/mol:	237.100108
ΔH_f, kcal/mol:	-139.3
Dipole, Da:	5.42
IP(EA), eV:	-10.06(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(4-ethoxyanilino)-2-oxoethyl] acetate

Drug info:

PubChemData

Smile

CC(=O)OCCS(=O)(=O)C1=CC=C(C=C1)C=C

DOS

IR

Vibrations