Geometry & MOs

Info

ID:	224230
PubChem CID:	85340352
Reduced:	NSO3C23H29 (1)
Stoich.:	ABC3D23E29 (1)
Weight, g/mol:	405.097915
ΔH_f, kcal/mol:	-119.15
Dipole, Da:	3.05
IP(EA), eV:	-8.69(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-(naphthalene-1-carbonyloxymethoxycarbonyl)bicyclo[3.1.0]hexane-6-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

CCCC1=CC2=C(S1)CNC3C2C4=CC(=C(C=C4CC3)OC(=O)C(C)(C)C)O

DOS

IR

Vibrations