Geometry & MOs

Info

ID:	204474
PubChem CID:	79968342
Reduced:	OSN3C13H17 (1)
Stoich.:	ABC3D13E17 (1)
Weight, g/mol:	230.054755
ΔH_f, kcal/mol:	-12.56
Dipole, Da:	7.49
IP(EA), eV:	-9.34(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[2-(1,4-oxathian-2-yl)-1,3-thiazol-4-yl]methanamine

Drug info:

PubChemData

Smile

CC(C)N1C(=O)N=C(C12CCCC3=C2C=CS3)N

DOS

IR

Vibrations