Geometry & MOs

Info

ID:	268007
PubChem CID:	103595253
Reduced:	OSN3C10H15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	263.134385
ΔH_f, kcal/mol:	7.51
Dipole, Da:	2.83
IP(EA), eV:	-8.4(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylthiomorpholin-3-yl)-(4-propylphenyl)methanone

Drug info:

PubChemData

Smile

CN1CCSCC1C(=O)C2=CN(N=C2)C

DOS

IR

Vibrations