Geometry & MOs

Info

ID:	3177
PubChem CID:	9277
Reduced:	BrOSN2C18H21 (1)
Stoich.:	ABCD2E18F21 (1)
Weight, g/mol:	392.0558
ΔH_f, kcal/mol:	0.62
Dipole, Da:	7.68
IP(EA), eV:	-8.33(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethyl-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)azanium;bromide

Drug info:

PubChemData

Smile

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)[N+](C)(C)C.[Br-]

DOS

IR

Vibrations