Geometry & MOs

Info

ID:	228204
PubChem CID:	87563661
Reduced:	NSO4C6H7 (1)
Stoich.:	ABC4D6E7 (1)
Weight, g/mol:	219.046633
ΔH_f, kcal/mol:	-134.7
Dipole, Da:	5.05
IP(EA), eV:	-10.77(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-pyridin-2-ylsulfanylimidazole-4-carbaldehyde

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)S(=O)(=O)O)CO

DOS

IR

Vibrations