Geometry & MOs

Info

ID:	359814
PubChem CID:	127299858
Reduced:	BrN7C15H16 (1)
Stoich.:	AB7C15D16 (1)
Weight, g/mol:	366.02623
ΔH_f, kcal/mol:	138.44
Dipole, Da:	3.27
IP(EA), eV:	-9.06(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-bromopyrazol-1-yl)piperidin-1-yl]-6-methylimidazo[2,1-b][1,3,4]thiadiazole

Drug info:

PubChemData

Smile

C1CN(CCC1N2C=C(C=N2)Br)C3=NC(=CN=C3)N4C=CC=N4

DOS

IR

Vibrations