Geometry & MOs

Info

ID:	189547
PubChem CID:	77871240
Reduced:	ClN2O2H15C16 (1)
Stoich.:	AB2C2D15E16 (1)
Weight, g/mol:	525.266128
ΔH_f, kcal/mol:	9.2
Dipole, Da:	5.91
IP(EA), eV:	-8.38(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(8-benzyl-8-azabicyclo[3.2.1]octan-1-yl)-3-[cyclohexyl(methyl)sulfamoyl]-2-methoxybenzamide

Drug info:

PubChemData

Smile

CN1CC(C=C2C1CC3=C(NC4=CC=CC2=C34)Cl)C(=O)O

DOS

IR

Vibrations