Geometry & MOs

Info

ID:	352510
PubChem CID:	127283598
Reduced:	SN2O3C12H20 (1)
Stoich.:	AB2C3D12E20 (1)
Weight, g/mol:	257.116427
ΔH_f, kcal/mol:	-124.22
Dipole, Da:	6.06
IP(EA), eV:	-9.64(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylidenepiperidin-1-yl)-(3-methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)methanone

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)CN2CCS(=O)(=O)CC2

DOS

IR

Vibrations