Geometry & MOs

Info

ID:	307358
PubChem CID:	125299678
Reduced:	NOH12C13 (2)
Stoich.:	ABC12D13 (2)
Weight, g/mol:	396.183778
ΔH_f, kcal/mol:	68.88
Dipole, Da:	1.12
IP(EA), eV:	-8.76(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-[[(2R)-2-methyl-2H-indol-3-yl]-[(2S)-2-methyl-2H-indol-3-yl]methyl]phenol

Drug info:

PubChemData

Smile

C[C@@H]1C(=C2C=CC=CC2=N1)C(C3=C(C(=CC=C3)OC)O)C4=C5C=CC=CC5=N[C@@H]4C

DOS

IR

Vibrations