Geometry & MOs

Info

ID:	64230
PubChem CID:	29198611
Reduced:	SN3O3C23H29 (1)
Stoich.:	AB3C3D23E29 (1)
Weight, g/mol:	427.192963
ΔH_f, kcal/mol:	-68.5
Dipole, Da:	7.56
IP(EA), eV:	-8.44(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-2-(1H-indol-3-yl)-2-morpholin-4-ylethyl]-2,4,6-trimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)S(=O)(=O)NC[C@@H](C2=CNC3=CC=CC=C32)N4CCOCC4

DOS

IR

Vibrations