Geometry & MOs

Info

ID:	141892
PubChem CID:	52947415
Reduced:	N2S2C31H38 (1)
Stoich.:	A2B2C31D38 (1)
Weight, g/mol:	531.159266
ΔH_f, kcal/mol:	46.76
Dipole, Da:	3.05
IP(EA), eV:	-8.0(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[2-[4-(7-chloroquinolin-4-yl)piperazin-1-yl]ethyl]-2-methoxyacridin-9-amine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C=C2SC3CCCCC3)/C(=C/SC4CCCCC4)/C5=CC=C(C=C5)C

DOS

IR

Vibrations