Geometry & MOs

Info

ID:	231487
PubChem CID:	87573877
Reduced:	N2O2F4C25H30 (1)
Stoich.:	A2B2C4D25E30 (1)
Weight, g/mol:	298.042356
ΔH_f, kcal/mol:	-277.44
Dipole, Da:	1.61
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-fluoro-11-oxo-1,7-diazatricyclo[6.3.1.04,12]dodeca-4(12),5,7,9-tetraen-2-yl)methyl methanesulfonate

Drug info:

PubChemData

Smile

CCC1=CC(=CC=C1)C2=C(C=CC=C2F)C(CCCNC(=O)C(F)(F)F)(C3CCCNC3)O

DOS

IR

Vibrations