Geometry & MOs

Info

ID:	16894
PubChem CID:	478728
Reduced:	NO6C20H25 (1)
Stoich.:	AB6C20D25 (1)
Weight, g/mol:	375.168188
ΔH_f, kcal/mol:	-262.25
Dipole, Da:	3.4
IP(EA), eV:	-9.01(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (9R,10R)-9,10-dihydroxy-4,8,8-trimethyl-2-oxo-9,10-dihydropyrano[2,3-h]quinoline-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C2=C1C=CC3=C2[C@H]([C@H](C(O3)(C)C)O)O)C(=O)OC(C)(C)C

DOS

IR

Vibrations