Geometry & MOs

Info

ID:	254362
PubChem CID:	103124685
Reduced:	ON2C17H22 (1)
Stoich.:	AB2C17D22 (1)
Weight, g/mol:	269.12766
ΔH_f, kcal/mol:	-7.3
Dipole, Da:	4.6
IP(EA), eV:	-8.87(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-propan-2-ylpyrazol-3-yl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone

Drug info:

PubChemData

Smile

CC1CCC(CC1C)C(=O)C2=NN(C3=CC=CC=C32)C

DOS

IR

Vibrations