Geometry & MOs

Info

ID:	46134
PubChem CID:	10522341
Reduced:	ClNPSH17C19 (1)
Stoich.:	ABCDE17F19 (1)
Weight, g/mol:	357.059028
ΔH_f, kcal/mol:	14.92
Dipole, Da:	6.16
IP(EA), eV:	-8.78(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2-(3-methoxyphenyl)-1,2,3,10-tetrahydrophenothiazin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)NCC3=CC=C(C=C3)Cl

DOS

IR

Vibrations