Geometry & MOs

Info

ID:	199707
PubChem CID:	79284393
Reduced:	N3O3C12H17 (1)
Stoich.:	A3B3C12D17 (1)
Weight, g/mol:	308.176775
ΔH_f, kcal/mol:	-53.43
Dipole, Da:	1.35
IP(EA), eV:	-10.31(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-chloroethyl)-1-ethyl-3-methyl-6-(1-methylcyclohexyl)imidazo[4,5-c]pyrazole

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN=C(O1)CN(CC#C)CC(=O)O

DOS

IR

Vibrations