Geometry & MOs

Info

ID:	430407
PubChem CID:	135170471
Reduced:	SN2C8H14 (1)
Stoich.:	AB2C8D14 (1)
Weight, g/mol:	166.146999
ΔH_f, kcal/mol:	11.5
Dipole, Da:	3.56
IP(EA), eV:	-8.36(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-5-(2-methylbutan-2-yl)pyrazole

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C(C)(C)SC

DOS

IR

Vibrations