Geometry & MOs

Info

ID:	73438
PubChem CID:	48417698
Reduced:	N2O2F3C23H23 (1)
Stoich.:	A2B2C3D23E23 (1)
Weight, g/mol:	397.197712
ΔH_f, kcal/mol:	-170.13
Dipole, Da:	3.0
IP(EA), eV:	-9.17(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]piperidin-1-yl]-2-oxoethyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC(=CC=C1)C(F)(F)F)C2CCN(CC2)C(=O)C3=CC4=CC=CC=C4O3

DOS

IR

Vibrations