Geometry & MOs

Info

ID:	241716
PubChem CID:	96024069
Reduced:	NO3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	285.136493
ΔH_f, kcal/mol:	-103.7
Dipole, Da:	2.76
IP(EA), eV:	-8.63(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1R)-6,7-dimethyl-1,2,3,4-tetrahydroisoquinolin-1-yl]benzene-1,2,3-triol

Drug info:

PubChemData

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CC1=CC2=C(C=C1C)[C@@H](NCC2)C3=CC(=C(C(=C3)O)O)O

DOS

IR

Vibrations