Geometry & MOs

Info

ID:	68464
PubChem CID:	46508464
Reduced:	FSN2O2H23C25 (1)
Stoich.:	ABC2D2E23F25 (1)
Weight, g/mol:	430.169271
ΔH_f, kcal/mol:	-53.84
Dipole, Da:	3.31
IP(EA), eV:	-8.98(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(5-fluoro-2-phenyl-1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)/C=C/C3=CC=C(S3)C4=CC=C(C=C4)F

DOS

IR

Vibrations