Geometry & MOs

Info

ID:	207685
PubChem CID:	80437928
Reduced:	O2N4C15H28 (1)
Stoich.:	A2B4C15D28 (1)
Weight, g/mol:	290.131654
ΔH_f, kcal/mol:	-21.71
Dipole, Da:	7.37
IP(EA), eV:	-9.37(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-(3-chloro-5-methylhexyl)-1,3-diethylpyrazole

Drug info:

PubChemData

Smile

CCCNC(CC1=C(C(=NN1CC)C)[N+](=O)[O-])CC(C)C

DOS

IR

Vibrations