Geometry & MOs

Info

ID:	44314
PubChem CID:	10502666
Reduced:	SiF3O3C22H31 (1)
Stoich.:	AB3C3D22E31 (1)
Weight, g/mol:	426.960348
ΔH_f, kcal/mol:	-311.23
Dipole, Da:	4.01
IP(EA), eV:	-9.08(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2-(2,4-dichlorophenyl)-5,5-dioxo-1,2,3,10-tetrahydrophenothiazin-4-one

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1OC(=O)C(F)(F)F)C)CC=C)O[Si](C)(C)C(C)(C)C)CC=C

DOS

IR

Vibrations