Geometry & MOs

Info

ID:	31302
PubChem CID:	855546
Reduced:	O3N4H12C15 (1)
Stoich.:	A3B4C12D15 (1)
Weight, g/mol:	301.062008
ΔH_f, kcal/mol:	-18.88
Dipole, Da:	7.46
IP(EA), eV:	-9.72(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-ethoxyanilino)-2-oxoethyl]sulfonylacetic acid

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=NN2CC(=O)NC3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations