Geometry & MOs

Info

ID:	212883
PubChem CID:	81062125
Reduced:	S2O3N4C11H18 (1)
Stoich.:	A2B3C4D11E18 (1)
Weight, g/mol:	284.173607
ΔH_f, kcal/mol:	-63.02
Dipole, Da:	5.61
IP(EA), eV:	-8.55(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[methyl(2-propan-2-yloxyethyl)carbamoyl]-7-azabicyclo[2.2.1]heptane-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=C(N=C2N1C=CS2)NC

DOS

IR

Vibrations