Geometry & MOs

Info

ID:	350592
PubChem CID:	127278627
Reduced:	SN2O4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	390.206719
ΔH_f, kcal/mol:	-154.25
Dipole, Da:	8.87
IP(EA), eV:	-9.38(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-3-[[1-[2-(2-oxopiperidin-1-yl)acetyl]piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

CN(CC1CCCO1)C(=O)C2=CC=CC(=C2)CN3CCS(=O)(=O)CC3

DOS

IR

Vibrations