Geometry & MOs

Info

ID:	364935
PubChem CID:	127316583
Reduced:	ON5C20H27 (1)
Stoich.:	AB5C20D27 (1)
Weight, g/mol:	292.189926
ΔH_f, kcal/mol:	25.05
Dipole, Da:	4.71
IP(EA), eV:	-8.67(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-cyclobutylpiperazin-1-yl)-(5-methoxy-1,3-dimethylpyrazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=C(N=N2)CC(=O)N3CCN(CC3)C4CCC4)C

DOS

IR

Vibrations