Geometry & MOs

Info

ID:	200033
PubChem CID:	79335217
Reduced:	NOC15H21 (1)
Stoich.:	ABC15D21 (1)
Weight, g/mol:	245.097127
ΔH_f, kcal/mol:	-28.83
Dipole, Da:	2.74
IP(EA), eV:	-8.09(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-(chloromethyl)-3-methylbut-1-enyl]quinoline

Drug info:

PubChemData

Smile

CC(C)C(=CC1=CC2=C(C=C1)N(CC2)C)CO

DOS

IR

Vibrations