Geometry & MOs

Info

ID:	235199
PubChem CID:	92304212
Reduced:	N2O3C25H30 (1)
Stoich.:	A2B3C25D30 (1)
Weight, g/mol:	406.225643
ΔH_f, kcal/mol:	-82.06
Dipole, Da:	6.06
IP(EA), eV:	-8.33(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)-N-(3-methylbutyl)propanamide

Drug info:

PubChemData

Smile

CCN1C=C(C2=CC=CC=C21)[C@@H](CC(=O)NCCC(C)C)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations