Geometry & MOs

Info

ID:	238010
PubChem CID:	92728790
Reduced:	ClSN4O4H19C23 (1)
Stoich.:	ABC4D4E19F23 (1)
Weight, g/mol:	480.183127
ΔH_f, kcal/mol:	-30.83
Dipole, Da:	4.97
IP(EA), eV:	-9.01(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-pyrrolidin-1-ylsulfonylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC(=NO1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)NC(=O)C4=CC=CC=C4

DOS

IR

Vibrations