Geometry & MOs

Info

ID:	264457
PubChem CID:	103463022
Reduced:	FCl2N2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	268.145474
ΔH_f, kcal/mol:	-55.91
Dipole, Da:	5.14
IP(EA), eV:	-9.13(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(chloromethyl)-6-(2,2-dimethylbutyl)-1,3-dimethylimidazo[4,5-c]pyrazole

Drug info:

PubChemData

Smile

CCC(C)(C)CN1C2=CC(=C(C=C2N=C1CCCl)Cl)F

DOS

IR

Vibrations