Geometry & MOs

Info

ID:	255221
PubChem CID:	103130739
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	283.99605
ΔH_f, kcal/mol:	-22.19
Dipole, Da:	5.24
IP(EA), eV:	-9.34(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromo-6-fluorophenyl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(C(C2=CC=CC=C2)OC)O

DOS

IR

Vibrations