Geometry & MOs

Info

ID:	198893
PubChem CID:	79169282
Reduced:	ClNOC10H14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	273.092042
ΔH_f, kcal/mol:	-40.02
Dipole, Da:	3.86
IP(EA), eV:	-8.84(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-2-(chloromethyl)-6-methylpyridine

Drug info:

PubChemData

Smile

CCCOC1=C(N=C(C=C1)C)CCl

DOS

IR

Vibrations