Geometry & MOs

Info

ID:	374040
PubChem CID:	131322861
Reduced:	NSO2C7H13 (1)
Stoich.:	ABC2D7E13 (1)
Weight, g/mol:	234.025227
ΔH_f, kcal/mol:	-87.78
Dipole, Da:	2.29
IP(EA), eV:	-8.75(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-hydroxy-4-methoxy-6-(trifluoromethoxy)pyridine-2-carbonitrile

Drug info:

PubChemData

Smile

COC(=O)C1CNCCCS1

DOS

IR

Vibrations