Geometry & MOs

Info

ID:	72572
PubChem CID:	48416318
Reduced:	O3N5C19H25 (1)
Stoich.:	A3B5C19D25 (1)
Weight, g/mol:	357.160103
ΔH_f, kcal/mol:	-104.76
Dipole, Da:	4.61
IP(EA), eV:	-8.6(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N(C1=O)CCC(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations