Geometry & MOs

Info

ID:	285395
PubChem CID:	104104191
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	278.072513
ΔH_f, kcal/mol:	-12.83
Dipole, Da:	3.19
IP(EA), eV:	-9.08(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(furan-2-yl)-1,3-thiazol-4-yl]-1-(oxazinan-2-yl)ethanone

Drug info:

PubChemData

Smile

C1CCON(C1)C(=O)C2CSC(=N2)C3=CC=CC=C3

DOS

IR

Vibrations