Geometry & MOs

Info

ID:	255016
PubChem CID:	103129342
Reduced:	OSN2C14H14 (1)
Stoich.:	ABC2D14E14 (1)
Weight, g/mol:	257.12766
ΔH_f, kcal/mol:	32.99
Dipole, Da:	3.27
IP(EA), eV:	-8.7(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-methylpyrazol-4-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-ol

Drug info:

PubChemData

Smile

CC1=C(C=CS1)C(C2=NN(C3=CC=CC=C32)C)O

DOS

IR

Vibrations