Geometry & MOs

Info

ID:	414141
PubChem CID:	135087096
Reduced:	IN2O2C14H15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	228.089878
ΔH_f, kcal/mol:	-8.1
Dipole, Da:	4.13
IP(EA), eV:	-8.95(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-2-hydroxypyrido[3,4-b]indole

Drug info:

PubChemData

Smile

COCN1C2=CC=CC=C2C(=C1I)C(=O)NCC=C

DOS

IR

Vibrations