Geometry & MOs

Info

ID:	391571
PubChem CID:	135006588
Reduced:	O2C7H7 (2)
Stoich.:	A2B7C7 (2)
Weight, g/mol:	293.033349
ΔH_f, kcal/mol:	-98.81
Dipole, Da:	4.3
IP(EA), eV:	-9.46(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylquinolizin-5-ium;trifluoromethanesulfonate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC[C@H](C2=C(C=CO2)C=O)O

DOS

IR

Vibrations