Geometry & MOs

Info

ID:	441908
PubChem CID:	135246588
Reduced:	NOC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	307.02079
ΔH_f, kcal/mol:	28.41
Dipole, Da:	2.5
IP(EA), eV:	-9.24(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-bromopyridin-2-yl)oxyphenyl]propan-1-ol

Drug info:

PubChemData

Smile

C/C=C(/C1=CC=CC=C1OC)\C(=NC=C)OC2=CN=CC=C2

DOS

IR

Vibrations