Geometry & MOs

Info

ID:	256979
PubChem CID:	103142875
Reduced:	OBr2C10H18 (1)
Stoich.:	AB2C10D18 (1)
Weight, g/mol:	299.071306
ΔH_f, kcal/mol:	-84.07
Dipole, Da:	4.71
IP(EA), eV:	-9.86(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-methoxyphenyl)-isoquinolin-8-ylmethanol

Drug info:

PubChemData

Smile

CC1CCC(O1)CC(C)(CBr)CBr

DOS

IR

Vibrations