Geometry & MOs

Info

ID:	365269
PubChem CID:	127317614
Reduced:	O2N3C20H27 (1)
Stoich.:	A2B3C20D27 (1)
Weight, g/mol:	326.174276
ΔH_f, kcal/mol:	-67.9
Dipole, Da:	2.32
IP(EA), eV:	-8.56(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-cyclobutylpiperazine-1-carbonyl)-1-methylcinnolin-4-one

Drug info:

PubChemData

Smile

C1CC(C1)N2CCN(CC2)C(=O)CNC(=O)C3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations