Geometry & MOs

Info

ID:	121982
PubChem CID:	50788662
Reduced:	SN3O3C24H33 (1)
Stoich.:	AB3C3D24E33 (1)
Weight, g/mol:	511.134797
ΔH_f, kcal/mol:	-96.47
Dipole, Da:	6.48
IP(EA), eV:	-8.98(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-5-(5-methyl-1,2,4-oxadiazol-3-yl)thiophen-3-yl]sulfonyl-N-(2-methylquinolin-4-yl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)N3CCNCC3

DOS

IR

Vibrations