Geometry & MOs

Info

ID:	235271
PubChem CID:	92304316
Reduced:	NO2C11H15 (2)
Stoich.:	AB2C11D15 (2)
Weight, g/mol:	378.194343
ΔH_f, kcal/mol:	-165.68
Dipole, Da:	4.62
IP(EA), eV:	-8.14(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(1,3-benzodioxol-5-yl)-3-(1-ethylindol-3-yl)-N-propylpropanamide

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C1C(=O)N3CCC[C@H](C3)C(=O)OCC)C(=CC=C2)OCC

DOS

IR

Vibrations