Geometry & MOs

Info

ID:	170884
PubChem CID:	75292155
Reduced:	NSO4C13H15 (1)
Stoich.:	ABC4D13E15 (1)
Weight, g/mol:	227.115758
ΔH_f, kcal/mol:	-100.17
Dipole, Da:	5.23
IP(EA), eV:	-9.38(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-5-ethylbicyclo[2.2.1]heptane-2,3-dicarboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC(=NO2)C(C)OS(=O)(=O)C

DOS

IR

Vibrations