Geometry & MOs

Info

ID:	272727
PubChem CID:	103753492
Reduced:	BrFON2H14C15 (1)
Stoich.:	ABCD2E14F15 (1)
Weight, g/mol:	349.01137
ΔH_f, kcal/mol:	-41.32
Dipole, Da:	5.95
IP(EA), eV:	-8.56(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-5-fluorophenyl)-3,4-dihydro-2H-chromene-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)F)Br

DOS

IR

Vibrations