Geometry & MOs

Info

ID:	351661
PubChem CID:	127280728
Reduced:	ON5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	292.201159
ΔH_f, kcal/mol:	59.28
Dipole, Da:	7.04
IP(EA), eV:	-8.7(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-[(1-methylpyrazol-4-yl)methyl]piperazin-1-yl]ethyl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CCC(C1)C2CCCN2CC3=NC(=O)C4=CNN(C4=N3)C5=CC=CC=C5

DOS

IR

Vibrations