Geometry & MOs

Info

ID:	430396
PubChem CID:	135170460
Reduced:	F2N2C9H14 (1)
Stoich.:	A2B2C9D14 (1)
Weight, g/mol:	172.076726
ΔH_f, kcal/mol:	-78.53
Dipole, Da:	2.41
IP(EA), eV:	-9.2(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloro-2-methylpropan-2-yl)-5-methyl-1H-pyrazole

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)C(C)(CF)CF)C

DOS

IR

Vibrations