Geometry & MOs

Info

ID:	287029
PubChem CID:	104231708
Reduced:	N2O2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	260.152478
ΔH_f, kcal/mol:	-40.48
Dipole, Da:	2.11
IP(EA), eV:	-9.28(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[2-methoxy-6-(3-propan-2-ylpyrazol-1-yl)phenyl]ethanol

Drug info:

PubChemData

Smile

CC(C)C1=NN(C=C1)C2=C(C(=CC=C2)OC)C(C)O

DOS

IR

Vibrations