Geometry & MOs

Info

ID:	275841
PubChem CID:	103818335
Reduced:	BrON2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	254.121927
ΔH_f, kcal/mol:	36.2
Dipole, Da:	2.12
IP(EA), eV:	-8.07(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-(1H-indol-7-ylmethyl)-5-methylaniline

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC=C2NCC3=C(C=CO3)Br)C=C1

DOS

IR

Vibrations