Geometry & MOs

Info

ID:	308065
PubChem CID:	125316810
Reduced:	NF3O5H12C17 (1)
Stoich.:	AB3C5D12E17 (1)
Weight, g/mol:	458.184172
ΔH_f, kcal/mol:	-278.85
Dipole, Da:	2.91
IP(EA), eV:	-10.52(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxy-2H-indol-3-yl)-3-(4-methoxyphenyl)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C2[C@H]([C@H](CC(=O)O2)C3=CC(=C(C(=C3)F)F)F)C(=O)N=C1

DOS

IR

Vibrations