Geometry & MOs

Info

ID:	341170
PubChem CID:	127263605
Reduced:	BrNOH14C16 (1)
Stoich.:	ABCD14E16 (1)
Weight, g/mol:	338.98705
ΔH_f, kcal/mol:	11.86
Dipole, Da:	2.5
IP(EA), eV:	-8.42(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-bromo-2-phenyl-5-(trifluoromethyl)-1H-indole

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)Br)NC(=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations