Geometry & MOs

Info

ID:	177436
PubChem CID:	76185564
Reduced:	ClFN2O2H6C11 (1)
Stoich.:	ABC2D2E6F11 (1)
Weight, g/mol:	371.1919
ΔH_f, kcal/mol:	-26.19
Dipole, Da:	6.72
IP(EA), eV:	-9.61(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10,12,16,19,19-pentamethyl-3-oxo-3lambda4-thia-10-azatricyclo[13.3.1.04,9]nonadeca-1,4,6,8,15-pentaen-11-one

Drug info:

PubChemData

Smile

C=C1C(=C(C(=O)N=N1)C2=C(C=CC=C2Cl)F)O

DOS

IR

Vibrations