Geometry & MOs

Info

ID:	340479
PubChem CID:	127262490
Reduced:	N2O2H12C13 (1)
Stoich.:	A2B2C12D13 (1)
Weight, g/mol:	276.089878
ΔH_f, kcal/mol:	-20.75
Dipole, Da:	5.15
IP(EA), eV:	-9.08(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyanophenyl) 2H-quinoline-1-carboxylate

Drug info:

PubChemData

Smile

C1C=CC2=CC=CC=C2N1C(=O)OCCC#N

DOS

IR

Vibrations