Geometry & MOs

Info

ID:	20667
PubChem CID:	585082
Reduced:	NSO3C21H31 (1)
Stoich.:	ABC3D21E31 (1)
Weight, g/mol:	377.202465
ΔH_f, kcal/mol:	-157.45
Dipole, Da:	6.27
IP(EA), eV:	-9.5(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1-adamantyloxy)ethyl]-2,4,6-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCOC23CC4CC(C2)CC(C4)C3)C

DOS

IR

Vibrations