Geometry & MOs

Info

ID:	227146
PubChem CID:	87560344
Reduced:	N2O2F3H11C13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	164.942044
ΔH_f, kcal/mol:	-161.79
Dipole, Da:	6.74
IP(EA), eV:	-9.36(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cobalt;sulfanyl propanoate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C=C(C(=N2)C(F)(F)F)C=O

DOS

IR

Vibrations