Geometry & MOs

Info

ID:	374723
PubChem CID:	131342551
Reduced:	OSN3C10H11 (1)
Stoich.:	ABC3D10E11 (1)
Weight, g/mol:	221.062283
ΔH_f, kcal/mol:	27.39
Dipole, Da:	4.55
IP(EA), eV:	-8.76(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)-2-hydroxypropanenitrile

Drug info:

PubChemData

Smile

CC1=NN(C=C1C(=O)C2=CSC(=C2)N)C

DOS

IR

Vibrations