Geometry & MOs

Info

ID:	443011
PubChem CID:	135257407
Reduced:	N5C44H45 (1)
Stoich.:	A5B44C45 (1)
Weight, g/mol:	736.266068
ΔH_f, kcal/mol:	132.72
Dipole, Da:	3.69
IP(EA), eV:	-8.15(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[9-(9,9-dimethyl-10H-acridin-2-yl)carbazol-3-yl]carbazol-9-yl]-10H-phenothiazine

Drug info:

PubChemData

Smile

CN1CCC(C2C1NCCC2)C3=CC=C(C=C3)N4C5CNC(CC5C6=CC=CC=C64)C7=CC=C(C=C7)N8C9=CC=CC=C9C1=CC=CC=C18

DOS

IR

Vibrations