Geometry & MOs

Info

ID:	270053
PubChem CID:	103624146
Reduced:	N2O2C19H28 (1)
Stoich.:	A2B2C19D28 (1)
Weight, g/mol:	310.262028
ΔH_f, kcal/mol:	-106.78
Dipole, Da:	3.54
IP(EA), eV:	-8.07(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(4-methylpentan-2-ylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC2CC3CCC(C2)N3C(=O)OC(C)(C)C

DOS

IR

Vibrations