Geometry & MOs

Info

ID:	412375
PubChem CID:	135085266
Reduced:	ON2H14C15 (1)
Stoich.:	AB2C14D15 (1)
Weight, g/mol:	217.053251
ΔH_f, kcal/mol:	21.9
Dipole, Da:	5.86
IP(EA), eV:	-9.47(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

6-chloro-1-methyl-9H-pyrido[2,3-b]indol-1-ium

Drug info:

PubChemData

Smile

CC(=C)C1=C(C=CN=C1)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations