Geometry & MOs

Info

ID:	279277
PubChem CID:	103842705
Reduced:	BrNOF2H8C13 (1)
Stoich.:	ABCD2E8F13 (1)
Weight, g/mol:	319.9972
ΔH_f, kcal/mol:	-78.63
Dipole, Da:	5.33
IP(EA), eV:	-9.27(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-2,5-difluorophenyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2F)Br)F

DOS

IR

Vibrations