Geometry & MOs

Info

ID:	234824
PubChem CID:	92303561
Reduced:	F2N2O4H20C21 (1)
Stoich.:	A2B2C4D20E21 (1)
Weight, g/mol:	419.220892
ΔH_f, kcal/mol:	-203.96
Dipole, Da:	3.31
IP(EA), eV:	-9.42(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(1,3-benzodioxol-5-yl)-3-(1H-indol-3-yl)-N-(2-piperidin-1-ylethyl)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=O)N[C@H]1C2=CC=C(C=C2)F)C)COC3=CC=CC=C3F

DOS

IR

Vibrations