Geometry & MOs

Info

ID:	297474
PubChem CID:	117618613
Reduced:	FO3N5H20C24 (1)
Stoich.:	AB3C5D20E24 (1)
Weight, g/mol:	226.01056
ΔH_f, kcal/mol:	-38.84
Dipole, Da:	3.23
IP(EA), eV:	-8.7(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-3,5-dicyclopropyl-1H-pyrazole

Drug info:

PubChemData

Smile

CC1=CN=C(C=C1)C(C2=NC=C(C=C2)F)(C3=C4C(=CC(=C3)C5=C(ON=C5C)C)NC(=O)N4)O

DOS

IR

Vibrations