Geometry & MOs

Info

ID:	398983
PubChem CID:	135036743
Reduced:	LiOC8H13 (1)
Stoich.:	ABC8D13 (1)
Weight, g/mol:	159.053158
ΔH_f, kcal/mol:	-0.28
Dipole, Da:	7.63
IP(EA), eV:	-6.42(2.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,5S)-6,8-dioxa-3-azabicyclo[3.2.1]octane-7-carboxylic acid

Drug info:

PubChemData

Smile

[Li+].C1CCC[C-]2[C@@H](O2)CC1

DOS

IR

Vibrations