Geometry & MOs

Info

ID:	156079
PubChem CID:	56369053
Reduced:	BrSN2O3C23H27 (1)
Stoich.:	ABC2D3E23F27 (1)
Weight, g/mol:	498.193691
ΔH_f, kcal/mol:	-71.69
Dipole, Da:	6.49
IP(EA), eV:	-9.4(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoyl]piperidin-3-yl]methyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCCN(C2)C(=O)C3(CC3)C4=CC(=CC=C4)Br

DOS

IR

Vibrations