Geometry & MOs

Info

ID:	287067
PubChem CID:	104231746
Reduced:	NOC8H11 (2)
Stoich.:	ABC8D11 (2)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-49.33
Dipole, Da:	5.15
IP(EA), eV:	-9.05(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-(3,5-diethylpyrazol-1-yl)-6-methoxyphenyl]ethanol

Drug info:

PubChemData

Smile

CCC1=CC(=NN1C2=C(C(=CC=C2)OC)C(C)O)CC

DOS

IR

Vibrations