Geometry & MOs

Info

ID:	188558
PubChem CID:	77733884
Reduced:	ClN2O6C12H19 (1)
Stoich.:	AB2C6D12E19 (1)
Weight, g/mol:	286.116486
ΔH_f, kcal/mol:	-298.73
Dipole, Da:	6.91
IP(EA), eV:	-10.5(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-carbamoyl-2-(1-carboxy-1-hydroxypropyl)bicyclo[3.1.0]hexane-6-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C(=O)O)(C1(CCC2C1(C2C(=O)O)C(=O)N)N)O.Cl

DOS

IR

Vibrations