Geometry & MOs

Info

ID:	365270
PubChem CID:	127317615
Reduced:	ON2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	234.148061
ΔH_f, kcal/mol:	-10.39
Dipole, Da:	7.24
IP(EA), eV:	-8.44(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-cyclobutylpiperazin-1-yl)-(1H-imidazol-5-yl)methanone

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)N3CCN(CC3)C4CCC4

DOS

IR

Vibrations