Geometry & MOs

Info

ID:	58482
PubChem CID:	24702034
Reduced:	N4C5H8 (1)
Stoich.:	A4B5C8 (1)
Weight, g/mol:	311.00695
ΔH_f, kcal/mol:	63.0
Dipole, Da:	2.43
IP(EA), eV:	-9.71(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2,5-dimethylpyrazol-3-yl)-4-fluorobenzamide

Drug info:

PubChemData

Smile

C1=CN(N=C1)CC(=N)N

DOS

IR

Vibrations