Geometry & MOs

Info

ID:	30824
PubChem CID:	841974
Reduced:	O3N4H8C10 (1)
Stoich.:	A3B4C8D10 (1)
Weight, g/mol:	293.105193
ΔH_f, kcal/mol:	4.71
Dipole, Da:	7.33
IP(EA), eV:	-10.66(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(3-methoxyphenyl)quinoline-4-carboxylate

Drug info:

PubChemData

Smile

C1=C[C@H]2[C@H]3[C@@H]([C@@H]1O2)C(=O)N(C3=O)N4C=NN=C4

DOS

IR

Vibrations