Geometry & MOs

Info

ID:	243789
PubChem CID:	99239619
Reduced:	SN4O4C24H30 (1)
Stoich.:	AB4C4D24E30 (1)
Weight, g/mol:	448.166808
ΔH_f, kcal/mol:	-71.61
Dipole, Da:	6.8
IP(EA), eV:	-10.11(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[3-[[2-(tert-butylsulfamoyl)phenyl]methylcarbamoyl]phenoxy]acetate

Drug info:

PubChemData

Smile

CCCC1=NOC2=C1C(=CC(=N2)C3CC3)C(=O)NCC4=CC=CC=C4S(=O)(=O)NC(C)(C)C

DOS

IR

Vibrations