Geometry & MOs

Info

ID:	25131
PubChem CID:	619391
Reduced:	BrN2O2F4H9C13 (1)
Stoich.:	AB2C2D4E9F13 (1)
Weight, g/mol:	249.001513
ΔH_f, kcal/mol:	-232.99
Dipole, Da:	5.59
IP(EA), eV:	-9.22(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-10H-phenothiazin-2-ol

Drug info:

PubChemData

Smile

COC(C(=O)NC1=C2C(=C(C=C1)Br)C=CC=N2)(C(F)(F)F)F

DOS

IR

Vibrations