Geometry & MOs

Info

ID:	402334
PubChem CID:	135055542
Reduced:	NO2H23C25 (1)
Stoich.:	AB2C23D25 (1)
Weight, g/mol:	391.05718
ΔH_f, kcal/mol:	4.6
Dipole, Da:	0.88
IP(EA), eV:	-8.68(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-2-(5-bromo-1H-indol-3-yl)-1,2-diphenylethanol

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(C1=O)(C/C=C/C3=CC=CC=C3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations