Geometry & MOs

Info

ID:	256719
PubChem CID:	103140919
Reduced:	BrNC16H18 (1)
Stoich.:	ABC16D18 (1)
Weight, g/mol:	316.01352
ΔH_f, kcal/mol:	25.43
Dipole, Da:	2.66
IP(EA), eV:	-9.2(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4-bromo-2,6-difluorophenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine

Drug info:

PubChemData

Smile

C1CCC(CC(C1)C2=CC=CC3=C2C=NC=C3)Br

DOS

IR

Vibrations