Geometry & MOs

Info

ID:	206955
PubChem CID:	80324743
Reduced:	SN3C9H11 (1)
Stoich.:	AB3C9D11 (1)
Weight, g/mol:	179.051718
ΔH_f, kcal/mol:	63.05
Dipole, Da:	1.6
IP(EA), eV:	-9.22(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methylpyrazol-1-yl)methyl]-1,3-thiazole

Drug info:

PubChemData

Smile

CC1=NN(C=C1)CC2=NC(=CS2)C

DOS

IR

Vibrations