Geometry & MOs

Info

ID:	445170
PubChem CID:	135264773
Reduced:	ON5C15H15 (1)
Stoich.:	AB5C15D15 (1)
Weight, g/mol:	296.93205
ΔH_f, kcal/mol:	100.5
Dipole, Da:	3.27
IP(EA), eV:	-8.91(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(hydroxymethyl)pyridin-2-yl]methoxy thiohypoiodite

Drug info:

PubChemData

Smile

CCC1=C(N=C2C(=CNN2C1=O)C#N)/C(=C/C=C\C)/N=C

DOS

IR

Vibrations