Geometry & MOs

Info

ID:	230734
PubChem CID:	87571784
Reduced:	FN2O12C35H41 (1)
Stoich.:	AB2C12D35E41 (1)
Weight, g/mol:	176.029468
ΔH_f, kcal/mol:	-520.74
Dipole, Da:	2.97
IP(EA), eV:	-8.46(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C(C)C)O[C@]2([C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)O)CC3=CC(=C(C=C3)OCC4=CC=CC=C4)F

DOS

IR

Vibrations