Geometry & MOs

Info

ID:	124936
PubChem CID:	50904763
Reduced:	SN2O6C23H32 (1)
Stoich.:	AB2C6D23E32 (1)
Weight, g/mol:	412.182064
ΔH_f, kcal/mol:	-242.57
Dipole, Da:	9.23
IP(EA), eV:	-9.37(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-4-[(1R,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octane-6-carbonyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C[C@]12C[C@@H](CC(C1)(C)C)N(C2)C(=O)COC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

DOS

IR

Vibrations