Geometry & MOs

Info

ID:	437995
PubChem CID:	135227448
Reduced:	SN2O3H12C15 (1)
Stoich.:	AB2C3D12E15 (1)
Weight, g/mol:	175.074562
ΔH_f, kcal/mol:	-0.89
Dipole, Da:	6.79
IP(EA), eV:	-9.82(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-N-methoxy-C-methylcarbonimidoyl]pyridine-4-carbonitrile

Drug info:

PubChemData

Smile

C/C(=N\OS(=O)(=O)C1=CC=CC=C1)/C2=CC=CC(=C2)C#N

DOS

IR

Vibrations