Geometry & MOs

Info

ID:	129851
PubChem CID:	51074050
Reduced:	O2N3C20H33 (1)
Stoich.:	A2B3C20D33 (1)
Weight, g/mol:	293.162708
ΔH_f, kcal/mol:	-92.85
Dipole, Da:	4.7
IP(EA), eV:	-8.89(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,8-dimethoxy-2-(oxolan-2-ylmethyl)-3,4-dihydro-1H-isoquinolin-4-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OCCN2CCCN(CC2)CC(=O)NC(C)(C)C

DOS

IR

Vibrations