Geometry & MOs

Info

ID:	430053
PubChem CID:	135170110
Reduced:	OF2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	315.137162
ΔH_f, kcal/mol:	-153.8
Dipole, Da:	4.3
IP(EA), eV:	-8.68(0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(E)-(3,3-dimethyl-1H-indol-2-ylidene)methyl]iminoquinolin-6-one

Drug info:

PubChemData

Smile

CN1CCC(=CC1)[C@@H]2CCCN2C(N3CCC(C3)(F)F)O

DOS

IR

Vibrations