Geometry & MOs

Info

ID:	361201
PubChem CID:	127302156
Reduced:	O3N4C17H22 (1)
Stoich.:	A3B4C17D22 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-67.13
Dipole, Da:	5.65
IP(EA), eV:	-8.46(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-[2-(2-methylcyclohexyl)oxyethyl]-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(CN1CCOCC1)NC(=O)C2=NN(C3=CC=CC=C3C2=O)C

DOS

IR

Vibrations