Geometry & MOs

Info

ID:	124306
PubChem CID:	50878121
Reduced:	BrNO2H8C11 (1)
Stoich.:	ABC2D8E11 (1)
Weight, g/mol:	305.027728
ΔH_f, kcal/mol:	-24.17
Dipole, Da:	1.0
IP(EA), eV:	-9.41(-1.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-1-(5-oxophenothiazin-10-yl)propan-1-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2C(=O)C=C(C2=O)Br

DOS

IR

Vibrations