Geometry & MOs

Info

ID:	1593
PubChem CID:	4744
Reduced:	SN3C20H25 (1)
Stoich.:	AB3C20D25 (1)
Weight, g/mol:	339.176919
ΔH_f, kcal/mol:	53.47
Dipole, Da:	4.8
IP(EA), eV:	-7.54(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=CC=CC=C42

DOS

IR

Vibrations