Geometry & MOs

Info

ID:	279490
PubChem CID:	103844106
Reduced:	BrN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	266.105528
ΔH_f, kcal/mol:	-13.6
Dipole, Da:	1.86
IP(EA), eV:	-9.58(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-quinazolin-4-yloxyphenyl)ethanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCO)OC2=NC=NC=C2Br

DOS

IR

Vibrations