Geometry & MOs

Info

ID:	255431
PubChem CID:	103131986
Reduced:	BrN2C9H15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	244.05751
ΔH_f, kcal/mol:	13.99
Dipole, Da:	4.76
IP(EA), eV:	-9.32(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-bromo-2-methylpentan-2-yl)-1-methylpyrazole

Drug info:

PubChemData

Smile

CC(CC(C)Br)C1=NN(C=C1)C

DOS

IR

Vibrations