Geometry & MOs

Info

ID:	60438
PubChem CID:	26686066
Reduced:	O2F3N4C24H29 (1)
Stoich.:	A2B3C4D24E29 (1)
Weight, g/mol:	409.236542
ΔH_f, kcal/mol:	-182.19
Dipole, Da:	6.24
IP(EA), eV:	-8.71(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(1,3-benzodioxol-5-yl)ethyl]-2-[methyl-[(2-piperidin-1-ylphenyl)methyl]amino]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC(=O)NC1=C(C(=C(C=C1)F)F)F)N(C)CC2=CC=CC=C2N3CCCCC3

DOS

IR

Vibrations