Geometry & MOs

Info

ID:	169325
PubChem CID:	75089496
Reduced:	ON3C11H13 (1)
Stoich.:	AB3C11D13 (1)
Weight, g/mol:	201.042593
ΔH_f, kcal/mol:	64.93
Dipole, Da:	7.15
IP(EA), eV:	-9.61(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methylidene-5-oxoquinoline-4-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=O)N=C2C1C(=NN2)C3CCC3

DOS

IR

Vibrations