Geometry & MOs

Info

ID:	403121
PubChem CID:	135058820
Reduced:	BNO5C19H28 (1)
Stoich.:	ABC5D19E28 (1)
Weight, g/mol:	309.100108
ΔH_f, kcal/mol:	-310.58
Dipole, Da:	3.12
IP(EA), eV:	-8.65(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(1-methoxy-2-oxoquinolin-4-yl)benzoate

Drug info:

PubChemData

Smile

[B-]12(C3=C(C=CC(=C3)OC(=O)C(C)(C)C)[NH+]=C(O1)C)OC(C(O2)(C)C)(C)C

DOS

IR

Vibrations