Geometry & MOs

Info

ID:	279315
PubChem CID:	103843033
Reduced:	BrNF2O2H8C9 (1)
Stoich.:	ABC2D2E8F9 (1)
Weight, g/mol:	318.01793
ΔH_f, kcal/mol:	-148.49
Dipole, Da:	3.96
IP(EA), eV:	-8.99(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2,5-difluoroanilino)-N-(cyclopropylmethyl)acetamide

Drug info:

PubChemData

Smile

COC(=O)CNC1=CC(=C(C=C1F)Br)F

DOS

IR

Vibrations