Geometry & MOs

Info

ID:	200285
PubChem CID:	79376406
Reduced:	OSN3C10H15 (1)
Stoich.:	ABC3D10E15 (1)
Weight, g/mol:	223.077933
ΔH_f, kcal/mol:	4.12
Dipole, Da:	6.22
IP(EA), eV:	-9.07(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-(oxolan-2-ylmethylamino)-1,2-thiazole-4-carbonitrile

Drug info:

PubChemData

Smile

CCOCCCNC1=C(C(=NS1)C)C#N

DOS

IR

Vibrations