Geometry & MOs

Info

ID:	205653
PubChem CID:	80132194
Reduced:	BrOF2N2C13H15 (1)
Stoich.:	ABC2D2E13F15 (1)
Weight, g/mol:	343.97721
ΔH_f, kcal/mol:	-116.8
Dipole, Da:	3.9
IP(EA), eV:	-9.23(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-5-fluorophenyl)-4-bromo-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN)C(=O)C2=C(C=C(C=C2F)Br)F

DOS

IR

Vibrations