Geometry & MOs

Info

ID:	205685
PubChem CID:	80133713
Reduced:	ClN2O2C14H23 (1)
Stoich.:	AB2C2D14E23 (1)
Weight, g/mol:	234.116841
ΔH_f, kcal/mol:	-86.29
Dipole, Da:	2.32
IP(EA), eV:	-9.38(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethylpyrazol-4-yl)-(3-fluoro-5-methylphenyl)methanol

Drug info:

PubChemData

Smile

CC(C)C1=NN(C(=C1C(CCC2CCCO2)O)Cl)C

DOS

IR

Vibrations