Geometry & MOs

Info

ID:	22660
PubChem CID:	598242
Reduced:	ON2H10C12 (1)
Stoich.:	AB2C10D12 (1)
Weight, g/mol:	198.079313
ΔH_f, kcal/mol:	23.34
Dipole, Da:	4.18
IP(EA), eV:	-8.48(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-9H-pyrido[3,4-b]indole

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3=C(N2)C=NC=C3

DOS

IR

Vibrations