Geometry & MOs

Info

ID:	373557
PubChem CID:	131317058
Reduced:	BrOS2C12H13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	159.043262
ΔH_f, kcal/mol:	-7.84
Dipole, Da:	3.15
IP(EA), eV:	-8.34(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-hydroxyimidazo[1,5-a]pyridine-1-carbonitrile

Drug info:

PubChemData

Smile

CCOC1=C2C=C(SC2=C(C=C1)CBr)SC

DOS

IR

Vibrations