Geometry & MOs

Info

ID:	403895
PubChem CID:	135062484
Reduced:	F2N2O9H22C30 (1)
Stoich.:	A2B2C9D22E30 (1)
Weight, g/mol:	510.058264
ΔH_f, kcal/mol:	-368.03
Dipole, Da:	9.17
IP(EA), eV:	-9.84(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC[C@@]2([C@H]([C@H](C(O2)N3C=C(C(=O)NC3=O)F)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)F

DOS

IR

Vibrations