Geometry & MOs

Info

ID:	361168
PubChem CID:	127302112
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	370.164105
ΔH_f, kcal/mol:	-41.81
Dipole, Da:	6.49
IP(EA), eV:	-8.64(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[4-(oxolane-2-carbonyl)piperazine-1-carbonyl]cinnolin-4-one

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)C1=NN(C2=CC=CC=C2C1=O)C)N3CCCCC3

DOS

IR

Vibrations