Geometry & MOs

Info

ID:	245915
PubChem CID:	103028014
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	334.03169
ΔH_f, kcal/mol:	-41.93
Dipole, Da:	4.52
IP(EA), eV:	-8.79(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-bromo-1-benzofuran-2-yl)-3-(2-methylpyrazol-3-yl)propan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)C(CCC2=CC=NN2C)O

DOS

IR

Vibrations