Geometry & MOs

Info

ID:	262497
PubChem CID:	103297009
Reduced:	FN2O5C13H13 (1)
Stoich.:	AB2C5D13E13 (1)
Weight, g/mol:	268.085935
ΔH_f, kcal/mol:	-156.3
Dipole, Da:	7.96
IP(EA), eV:	-10.41(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-fluoro-3-methyl-5-nitrophenyl)-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1F)C(=O)NC2(CCC2)C(=O)O)[N+](=O)[O-]

DOS

IR

Vibrations