Geometry & MOs

Info

ID:	123525
PubChem CID:	50852465
Reduced:	ClFOSH10C14 (1)
Stoich.:	ABCDE10F14 (1)
Weight, g/mol:	462.126569
ΔH_f, kcal/mol:	-45.46
Dipole, Da:	5.14
IP(EA), eV:	-9.12(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dichloro-N-(9,10-dihydroanthracen-9-ylmethyl)-2-(ethoxymethyl)quinolin-4-amine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=O)Cl)SCC2=CC=C(C=C2)F

DOS

IR

Vibrations