Geometry & MOs

Info

ID:	406746
PubChem CID:	135078518
Reduced:	O3C17H20 (1)
Stoich.:	A3B17C20 (1)
Weight, g/mol:	352.94037
ΔH_f, kcal/mol:	-123.66
Dipole, Da:	3.73
IP(EA), eV:	-9.32(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromoquinolizin-5-ium;hexafluorophosphate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CC2(C(=O)CCC2=O)CCC(=O)C

DOS

IR

Vibrations