Geometry & MOs

Info

ID:	73428
PubChem CID:	48417673
Reduced:	OF3N4C20H23 (1)
Stoich.:	AB3C4D20E23 (1)
Weight, g/mol:	380.171162
ΔH_f, kcal/mol:	-142.12
Dipole, Da:	7.59
IP(EA), eV:	-9.15(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methylfuran-2-yl)-[4-[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN=C(C=N1)C(=O)N2CCC(CC2)N(C)CC3=CC(=CC=C3)C(F)(F)F

DOS

IR

Vibrations