Geometry & MOs

Info

ID:	48451
PubChem CID:	10584860
Reduced:	NO5C9H15 (1)
Stoich.:	AB5C9D15 (1)
Weight, g/mol:	218.050809
ΔH_f, kcal/mol:	-227.21
Dipole, Da:	1.42
IP(EA), eV:	-9.86(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(dimethoxyphosphorylmethyl)-2-fluorobenzene

Drug info:

PubChemData

Smile

CO[C@]12CCC(=O)N1C[C@@H]([C@@H]([C@@H]2O)O)O

DOS

IR

Vibrations