Geometry & MOs

Info

ID:	286546
PubChem CID:	104170994
Reduced:	IN2O3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	280.00726
ΔH_f, kcal/mol:	-118.23
Dipole, Da:	4.74
IP(EA), eV:	-9.47(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-iodo-1-(2-methoxypropyl)-4-methylpyrazole

Drug info:

PubChemData

Smile

CCCN1C=C(C(=O)N(C1=O)CC(C)OC)I

DOS

IR

Vibrations