Geometry & MOs

Info

ID:	2009
PubChem CID:	5566
Reduced:	SF3N3C21H24 (1)
Stoich.:	AB3C3D21E24 (1)
Weight, g/mol:	407.164303
ΔH_f, kcal/mol:	-112.55
Dipole, Da:	3.67
IP(EA), eV:	-7.94(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

DOS

IR

Vibrations