Geometry & MOs

Info

ID:	310165
PubChem CID:	126575980
Reduced:	NO2C11H23 (1)
Stoich.:	AB2C11D23 (1)
Weight, g/mol:	240.183778
ΔH_f, kcal/mol:	-109.17
Dipole, Da:	1.78
IP(EA), eV:	-8.78(1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-pentan-3-yl-3,8-diazabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CCC(CC)OCCN1CCOCC1

DOS

IR

Vibrations