Geometry & MOs

Info

ID:	378713
PubChem CID:	134224808
Reduced:	N2O3C15H24 (1)
Stoich.:	A2B3C15D24 (1)
Weight, g/mol:	281.142722
ΔH_f, kcal/mol:	-108.18
Dipole, Da:	5.67
IP(EA), eV:	-9.38(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[(1R)-8-fluoro-3,4-dihydro-1H-isochromen-1-yl]methyl]carbamate

Drug info:

PubChemData

Smile

C/C=C(/C#N)\C(=C)C(CN(C)C(=O)OC(C)(C)C)OC

DOS

IR

Vibrations