Geometry & MOs

Info

ID:	382918
PubChem CID:	134974357
Reduced:	INOSiC19H34 (1)
Stoich.:	ABCDE19F34 (1)
Weight, g/mol:	268.084792
ΔH_f, kcal/mol:	-14.03
Dipole, Da:	1.81
IP(EA), eV:	-8.74(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-5-hydroxyphenyl)-7-hydroxy-2H-isoquinolin-6-one

Drug info:

PubChemData

Smile

CC1CC2C3C(CC4CC2(C(C1)N3C4)I)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations