Geometry & MOs

Info

ID:	383136
PubChem CID:	134974697
Reduced:	N2H19C23 (1)
Stoich.:	A2B19C23 (1)
Weight, g/mol:	322.146999
ΔH_f, kcal/mol:	110.56
Dipole, Da:	1.09
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.902215
Charge, e:	0

Chem-info

IUPAC name:

3-[1H-indol-3-yl(phenyl)methyl]-3H-indole

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C2C=[NH+]C3=CC=CC=C23)C4=CNC5=CC=CC=C54

DOS

IR

Vibrations