Geometry & MOs

Info

ID:	270052
PubChem CID:	103624097
Reduced:	N2O2C13H20 (1)
Stoich.:	A2B2C13D20 (1)
Weight, g/mol:	316.215078
ΔH_f, kcal/mol:	-85.33
Dipole, Da:	2.51
IP(EA), eV:	-9.44(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(4-methylanilino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)N(CCO)C(=O)NCC1=CC=CC=C1

DOS

IR

Vibrations