Geometry & MOs

Info

ID:	413541
PubChem CID:	135086490
Reduced:	FO2N3C22H22 (1)
Stoich.:	AB2C3D22E22 (1)
Weight, g/mol:	197.107873
ΔH_f, kcal/mol:	-79.43
Dipole, Da:	6.02
IP(EA), eV:	-8.66(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1,2-dimethyl-9H-pyrido[2,3-b]indol-1-ium

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)NC1=CC=CC=C1C2=C(C=C(C=N2)C3=C(C=C(C=C3)O)N)F

DOS

IR

Vibrations