Geometry & MOs

Info

ID:	315248
PubChem CID:	126625268
Reduced:	N2C11H19 (2)
Stoich.:	A2B11C19 (2)
Weight, g/mol:	492.31883
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	3.2
IP(EA), eV:	-8.77(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(1,4-dimethylpyrazol-3-yl)propyl]-1,4-dimethyl-5-[5-[5-propan-2-yl-3-(trifluoromethyl)pyrazol-1-yl]hexan-2-yl]pyrazole

Drug info:

PubChemData

Smile

CCC1=CC(=NN1C(C)(C)C)CCC(C)N2C(=CC(=N2)C(C)C)C(C)C

DOS

IR

Vibrations