Geometry & MOs

Info

ID:	308016
PubChem CID:	125311814
Reduced:	SO2N5C17H17 (1)
Stoich.:	AB2C5D17E17 (1)
Weight, g/mol:	355.110296
ΔH_f, kcal/mol:	38.65
Dipole, Da:	7.02
IP(EA), eV:	-9.07(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(3H-indol-6-yl)-1,2,4-oxadiazol-5-yl]-N-[(2S)-4-methyl-2,5-dihydro-1,3-thiazol-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1=N[C@H](SC1)NC(=O)CCC2=NC(=NO2)C3=CC4=C(CC=N4)C=C3

DOS

IR

Vibrations