Geometry & MOs

Info

ID:	334251
PubChem CID:	127252803
Reduced:	N3O5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	462.179087
ΔH_f, kcal/mol:	-148.09
Dipole, Da:	4.66
IP(EA), eV:	-8.45(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-6-methyl-4-oxopyran-2-yl)-N-(2-indol-1-ylethyl)propanamide

Drug info:

PubChemData

Smile

CNC(=O)[C@@H]1CC2=CC(=C(C=C2CN1C(=O)CN3CC4=CC=CC=C4C3=O)OC)OC

DOS

IR

Vibrations