Geometry & MOs

Info

ID:	359833
PubChem CID:	127299877
Reduced:	FON7C16H22 (1)
Stoich.:	ABC7D16E22 (1)
Weight, g/mol:	390.243104
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	10.6
IP(EA), eV:	-8.71(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-3-[[1-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

CN1C(=NN=N1)CN2CCCC(C2)CNC(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations