Geometry & MOs

Info

ID:	355120
PubChem CID:	127288052
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	362.175419
ΔH_f, kcal/mol:	-113.13
Dipole, Da:	1.84
IP(EA), eV:	-8.28(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluorophenyl)-3-[[1-[(2R)-5-oxopyrrolidine-2-carbonyl]piperidin-3-yl]methyl]urea

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)N2CCC(C2)CNC(=O)[C@H]3CCC(=O)N3

DOS

IR

Vibrations