Geometry & MOs

Info

ID:	14661
PubChem CID:	417092
Reduced:	ON2H18C21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	314.141913
ΔH_f, kcal/mol:	58.12
Dipole, Da:	1.19
IP(EA), eV:	-8.03(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-(2-methyl-1H-isoquinolin-1-yl)ethenyl]quinolin-8-ol

Drug info:

PubChemData

Smile

CN1C=CC2=CC=CC=C2C1C=CC3=C4C=CC=NC4=C(C=C3)O

DOS

IR

Vibrations