Geometry & MOs

Info

ID:	395931
PubChem CID:	135026956
Reduced:	NO3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	375.116546
ΔH_f, kcal/mol:	-70.39
Dipole, Da:	0.62
IP(EA), eV:	-9.2(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,7R,11S)-12-(2,2-dimethyl-1,3-dioxolan-4-yl)-6,7,11-trihydroxy-7-(hydroxymethyl)-4,9-dioxa-2-azatricyclo[6.3.1.01,5]dodecane-3,10-dione

Drug info:

PubChemData

Smile

CC(=O)N1C(C(=O)C2=C1C=C(C=C2)OC)C3=CC=CC=C3

DOS

IR

Vibrations