Geometry & MOs

Info

ID:

144960

PubChem CID:

53439296

Reduced:

ClN2C12H20 (1)

Stoich.:

AB2C12D20 (1)

Weight, g/mol:

212.974819

ΔHf, kcal/mol:

36.6

Dipole, Da:

2.13

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.812439

Charge, e:

0

Chem-info

IUPAC name:

4,7-dichloroquinolin-8-ol

Drug info:

PubChemData

Smile

CC[N+](CC)(CCN)C1=CC=C(C=C1)Cl

DOS

IR

Vibrations