Geometry & MOs

Info

ID:	254951
PubChem CID:	103128860
Reduced:	BrO2N3H14C15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	346.03169
ΔH_f, kcal/mol:	10.63
Dipole, Da:	3.18
IP(EA), eV:	-9.06(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-5-methoxyphenyl)-1-pyrazolo[1,5-a]pyridin-3-ylethanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)Br)CC(C2=C3C=NC=CN3N=C2)O

DOS

IR

Vibrations