Geometry & MOs

Info

ID:	89559
PubChem CID:	49962649
Reduced:	O2C9H12 (2)
Stoich.:	A2B9C12 (2)
Weight, g/mol:	262.131742
ΔH_f, kcal/mol:	-132.65
Dipole, Da:	2.52
IP(EA), eV:	-8.28(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-dimethoxyphenyl)-(2-ethylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CCCCCC1=CC=C(O1)C(C2=CC(=C(C=C2)OC)OC)O

DOS

IR

Vibrations