Geometry & MOs

Info

ID:	64283
PubChem CID:	29198864
Reduced:	SN3O4C24H31 (1)
Stoich.:	AB3C4D24E31 (1)
Weight, g/mol:	457.203528
ΔH_f, kcal/mol:	-107.61
Dipole, Da:	4.43
IP(EA), eV:	-8.55(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethoxy-N-[(2S)-2-(1H-indol-3-yl)-2-morpholin-4-ylethyl]-3,5-dimethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)COC1=CC=C(C=C1)S(=O)(=O)NC[C@@H](C2=CNC3=CC=CC=C32)N4CCOCC4

DOS

IR

Vibrations