Geometry & MOs

Info

ID:	438308
PubChem CID:	135228041
Reduced:	OF2N7H23C24 (1)
Stoich.:	AB2C7D23E24 (1)
Weight, g/mol:	419.0081
ΔH_f, kcal/mol:	18.15
Dipole, Da:	4.66
IP(EA), eV:	-8.12(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[bis(4-fluorophenyl)methyl]-5-bromo-2-nitropyridin-3-amine

Drug info:

PubChemData

Smile

CC1=C(N(N=N1)C)C2=CC3=C(C=C2)NC(N3C(C4=C(C=CC=N4)F)C5=C(C=CC=N5)F)(C)OC

DOS

IR

Vibrations