Geometry & MOs

Info

ID:	48990
PubChem CID:	11528589
Reduced:	OC4H6 (3)
Stoich.:	AB4C6 (3)
Weight, g/mol:	210.115698
ΔH_f, kcal/mol:	-141.91
Dipole, Da:	3.87
IP(EA), eV:	-10.41(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-ethyl-1-methylpyrido[3,4-b]indole

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@]1([C@H]2C=C(C(=O)O2)C)O

DOS

IR

Vibrations