Geometry & MOs

Info

ID:	123064
PubChem CID:	50831778
Reduced:	SN4O5C24H28 (1)
Stoich.:	AB4C5D24E28 (1)
Weight, g/mol:	433.14199
ΔH_f, kcal/mol:	-179.99
Dipole, Da:	5.91
IP(EA), eV:	-8.79(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,4-dimethoxyphenyl)-3-[(4-piperidin-1-ylsulfonylimidazol-1-yl)methyl]-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N(C3=O)CCC(=O)N4CCCC4)C

DOS

IR

Vibrations