Geometry & MOs

Info

ID:	302622
PubChem CID:	124385316
Reduced:	NO5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	340.158706
ΔH_f, kcal/mol:	-195.05
Dipole, Da:	4.78
IP(EA), eV:	-9.44(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6-fluoro-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Drug info:

PubChemData

Smile

CCC(=O)N[C@@H](CC(=O)C1=CC(=CC=C1)OC)C(=O)O

DOS

IR

Vibrations