Geometry & MOs

Info

ID:	387827
PubChem CID:	134987064
Reduced:	NO2C15H19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	247.120843
ΔH_f, kcal/mol:	-59.51
Dipole, Da:	4.62
IP(EA), eV:	-8.61(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-6,7-dimethoxy-1-methylisoquinoline

Drug info:

PubChemData

Smile

CCCCC1=CC2=CC(=CC(=C2C=N1)OC)OC

DOS

IR

Vibrations