Geometry & MOs

Info

ID:	72569
PubChem CID:	48416315
Reduced:	ClFO2N5C20H23 (1)
Stoich.:	ABC2D5E20F23 (1)
Weight, g/mol:	382.211724
ΔH_f, kcal/mol:	-83.07
Dipole, Da:	6.1
IP(EA), eV:	-9.21(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[3-(2-oxoimidazolidin-1-yl)piperidine-1-carbonyl]piperidin-1-yl]pyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1=NN(C(=C1C(=O)N2CCCC(C2)N3CCNC3=O)Cl)CC4=CC=C(C=C4)F

DOS

IR

Vibrations