Geometry & MOs

Info

ID:	442396
PubChem CID:	135251815
Reduced:	FSN3C24H30 (1)
Stoich.:	ABC3D24E30 (1)
Weight, g/mol:	437.250084
ΔH_f, kcal/mol:	-9.11
Dipole, Da:	5.99
IP(EA), eV:	-7.59(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-10-[4-(4-pyrrolidin-1-ylpiperidin-1-yl)butyl]phenothiazine

Drug info:

PubChemData

Smile

C1CCN(C1)C2CCN(CC2)CCCN3C4=CC=CC=C4SC5=C3C=C(C=C5)F

DOS

IR

Vibrations