Geometry & MOs

Info

ID:	410714
PubChem CID:	135083515
Reduced:	NSO2C12H15 (1)
Stoich.:	ABC2D12E15 (1)
Weight, g/mol:	679.056557
ΔH_f, kcal/mol:	-48.05
Dipole, Da:	3.47
IP(EA), eV:	-9.98(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

carbon monoxide;dimethyl 7-(3-ethoxy-3-oxopropyl)-5,6-dimethyl-7-phosphoniabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate;tungsten

Drug info:

PubChemData

Smile

C1CCC(C1)/C=N\S(=O)(=O)C2=CC=CC=C2

DOS

IR

Vibrations