Geometry & MOs

Info

ID:	412422
PubChem CID:	135085313
Reduced:	OSH10C11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	216.045426
ΔH_f, kcal/mol:	55.36
Dipole, Da:	4.09
IP(EA), eV:	-9.49(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-8-methyl-9H-pyrido[2,3-b]indole

Drug info:

PubChemData

Smile

C=CCCC(=O)C#CC1=CC=CS1

DOS

IR

Vibrations