Geometry & MOs

Info

ID:	254357
PubChem CID:	103124603
Reduced:	ON2H10C12 (1)
Stoich.:	AB2C10D12 (1)
Weight, g/mol:	362.98686
ΔH_f, kcal/mol:	62.42
Dipole, Da:	3.33
IP(EA), eV:	-9.37(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-iodophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanone

Drug info:

PubChemData

Smile

C#CCCC(=O)C1=C2C=CC=CN2N=C1

DOS

IR

Vibrations