Geometry & MOs

Info

ID:	157221
PubChem CID:	56422413
Reduced:	SN2O5C19H22 (1)
Stoich.:	AB2C5D19E22 (1)
Weight, g/mol:	343.153206
ΔH_f, kcal/mol:	-180.2
Dipole, Da:	3.16
IP(EA), eV:	-9.04(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-dioxolan-2-yl)piperidin-1-yl]-[4-(3-methyl-1,2,4-oxadiazol-5-yl)phenyl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2OCCO2)C(=O)C3=CC=CC(=C3)CN4C(=O)CSC4=O

DOS

IR

Vibrations