Geometry & MOs

Info

ID:	230762
PubChem CID:	87571945
Reduced:	FN2O7C21H29 (1)
Stoich.:	AB2C7D21E29 (1)
Weight, g/mol:	297.230803
ΔH_f, kcal/mol:	-330.37
Dipole, Da:	2.48
IP(EA), eV:	-9.07(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CC2=C(N(N=C2O[C@]3([C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)C(C)C)C)F

DOS

IR

Vibrations