Geometry & MOs

Info

ID:	35266
PubChem CID:	7979602
Reduced:	SN3O6C18H27 (1)
Stoich.:	AB3C6D18E27 (1)
Weight, g/mol:	419.187878
ΔH_f, kcal/mol:	-258.32
Dipole, Da:	6.71
IP(EA), eV:	-10.01(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]adamantane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NC(C)(C)C

DOS

IR

Vibrations