Geometry & MOs

Info

ID:	398275
PubChem CID:	135032631
Reduced:	N3O3C25H25 (1)
Stoich.:	A3B3C25D25 (1)
Weight, g/mol:	345.121237
ΔH_f, kcal/mol:	11.86
Dipole, Da:	4.42
IP(EA), eV:	-8.75(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,8S)-9-(hydroxymethyl)-3-naphthalen-2-yl-1,10-dioxa-2-azaspiro[4.5]dec-2-ene-6,7,8-triol

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C2=NN(N=C2)C(CC(=O)C3=CC=C(C=C3)OC)C4=CC=CO4

DOS

IR

Vibrations