Geometry & MOs

Info

ID:	1596
PubChem CID:	4747
Reduced:	OSN3C21H23 (1)
Stoich.:	ABC3D21E23 (1)
Weight, g/mol:	365.156184
ΔH_f, kcal/mol:	27.88
Dipole, Da:	5.72
IP(EA), eV:	-8.08(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-[3-(4-hydroxypiperidin-1-yl)propyl]phenothiazine-2-carbonitrile

Drug info:

PubChemData

Smile

C1CN(CCC1O)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C#N

DOS

IR

Vibrations