Geometry & MOs

Info

ID:	89689
PubChem CID:	49963719
Reduced:	OF3H13C15 (1)
Stoich.:	AB3C13D15 (1)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	-168.26
Dipole, Da:	3.1
IP(EA), eV:	-9.5(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethoxyphenyl)-(2-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C2=CC=CC=C2C(F)(F)F)O

DOS

IR

Vibrations