Geometry & MOs

Info

ID:	430406
PubChem CID:	135170470
Reduced:	FN2C8H13 (1)
Stoich.:	AB2C8D13 (1)
Weight, g/mol:	170.08777
ΔH_f, kcal/mol:	-36.61
Dipole, Da:	2.2
IP(EA), eV:	-9.43(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-3-(2-methylsulfanylpropan-2-yl)-1H-pyrazole

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C(C)(C)CF

DOS

IR

Vibrations