Geometry & MOs

Info

ID:	6190
PubChem CID:	67416
Reduced:	SO2Cl3N3C23H30 (1)
Stoich.:	AB2C3D3E23F30 (1)
Weight, g/mol:	517.112431
ΔH_f, kcal/mol:	-121.82
Dipole, Da:	4.06
IP(EA), eV:	-7.9(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3-(2-chlorophenothiazin-10-yl)propyl]piperazin-1-yl]ethyl acetate;dihydrochloride

Drug info:

PubChemData

Smile

CC(=O)OCCN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.Cl.Cl

DOS

IR

Vibrations