Geometry & MOs

Info

ID:	157213
PubChem CID:	56422405
Reduced:	SN2O3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	346.189257
ΔH_f, kcal/mol:	-71.13
Dipole, Da:	4.33
IP(EA), eV:	-8.74(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1,3-dioxolan-2-yl)piperidin-1-yl]-(4-morpholin-4-ylphenyl)methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2OCCO2)C(=O)C3=CC=C(C=C3)SC4=CC=CC=N4

DOS

IR

Vibrations