Geometry & MOs

Info

ID:	11577
PubChem CID:	117931
Reduced:	ON2C18H18 (1)
Stoich.:	AB2C18D18 (1)
Weight, g/mol:	278.141913
ΔH_f, kcal/mol:	26.63
Dipole, Da:	3.14
IP(EA), eV:	-8.38(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[N-(quinolin-2-ylmethyl)anilino]ethanol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(CCO)CC2=NC3=CC=CC=C3C=C2

DOS

IR

Vibrations