Geometry & MOs

Info

ID:	44233
PubChem CID:	10502110
Reduced:	FO3N4H19C23 (1)
Stoich.:	AB3C4D19E23 (1)
Weight, g/mol:	418.183897
ΔH_f, kcal/mol:	-68.77
Dipole, Da:	12.12
IP(EA), eV:	-8.94(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-pentan-2-yloxyoxan-2-yl]methyl acetate

Drug info:

PubChemData

Smile

C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=CC5=C4C=CC=N5)F

DOS

IR

Vibrations