Geometry & MOs

Info

ID:	33726
PubChem CID:	7887777
Reduced:	FNO4C19H24 (1)
Stoich.:	ABC4D19E24 (1)
Weight, g/mol:	375.111815
ΔH_f, kcal/mol:	-209.35
Dipole, Da:	5.95
IP(EA), eV:	-9.06(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCCC1=CCCCC1)OC(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations