Geometry & MOs

Info

ID:	89639
PubChem CID:	49963249
Reduced:	ON3H11C13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	344.098334
ΔH_f, kcal/mol:	62.54
Dipole, Da:	5.08
IP(EA), eV:	-9.71(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[hydroxy-(10-methylphenothiazin-1-yl)methyl]benzonitrile

Drug info:

PubChemData

Smile

C=CN1C=CN=C1C(C2=CC=C(C=C2)C#N)O

DOS

IR

Vibrations