Geometry & MOs

Info

ID:	157829
PubChem CID:	56437492
Reduced:	NO3C11H14 (2)
Stoich.:	AB3C11D14 (2)
Weight, g/mol:	426.218843
ΔH_f, kcal/mol:	-224.97
Dipole, Da:	7.58
IP(EA), eV:	-8.92(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[5-(diethylsulfamoyl)-2-methylbenzoyl]-methylamino]butanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CCCN(C)C(=O)COC1=CC=CC(=C1)NC(=O)C2=CC=CO2

DOS

IR

Vibrations