Geometry & MOs

Info

ID:	386784
PubChem CID:	134982920
Reduced:	BON2F4C28H29 (1)
Stoich.:	ABC2D4E28F29 (1)
Weight, g/mol:	510.246556
ΔH_f, kcal/mol:	-231.01
Dipole, Da:	14.51
IP(EA), eV:	-8.7(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethyl-[3-[4-(2-methyl-7H-indeno[2,1-c]quinolin-6-yl)phenoxy]propyl]azanium;tetrafluoroborate

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.C[N+](C)(C)CCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C4=C2CC5=CC=CC=C54

DOS

IR

Vibrations