Geometry & MOs

Info

ID:	338529
PubChem CID:	127259221
Reduced:	NSO5C11H13 (1)
Stoich.:	ABC5D11E13 (1)
Weight, g/mol:	378.088557
ΔH_f, kcal/mol:	-179.87
Dipole, Da:	5.37
IP(EA), eV:	-10.12(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[benzyl-(2-nitrophenyl)sulfamoyl]ethyl acetate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1S(=O)(=O)NC(C=O)OC(=O)C

DOS

IR

Vibrations