Geometry & MOs

Info

ID:	307113
PubChem CID:	125267677
Reduced:	FN4O6C33H35 (1)
Stoich.:	AB4C6D33E35 (1)
Weight, g/mol:	504.220164
ΔH_f, kcal/mol:	-167.04
Dipole, Da:	12.0
IP(EA), eV:	-8.65(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-[(4-methoxyphenyl)-[(2S)-2-phenyl-2H-indol-3-yl]methyl]-2-phenyl-2H-indole

Drug info:

PubChemData

Smile

CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)NCC(=O)NCCC4=C5C=C(C=CC5=NC4)F)OC)OC)OC

DOS

IR

Vibrations