Geometry & MOs

Info

ID:	365318
PubChem CID:	127317702
Reduced:	N6C17H24 (1)
Stoich.:	A6B17C24 (1)
Weight, g/mol:	319.237211
ΔH_f, kcal/mol:	106.29
Dipole, Da:	6.98
IP(EA), eV:	-8.46(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyclobutylpiperazin-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)CCC3=NN=NN3C4=CC=CC=C4

DOS

IR

Vibrations