Geometry & MOs

Info

ID:	124734
PubChem CID:	50894430
Reduced:	ClNSO3C12H16 (1)
Stoich.:	ABCD3E12F16 (1)
Weight, g/mol:	401.025535
ΔH_f, kcal/mol:	-118.97
Dipole, Da:	3.5
IP(EA), eV:	-9.82(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[benzyl-(2,5-dichlorophenyl)sulfonylamino]acetate

Drug info:

PubChemData

Smile

CCS(=O)(=O)N(CC1=CC=CC=C1)C(C)C(=O)Cl

DOS

IR

Vibrations