Geometry & MOs

Info

ID:	271807
PubChem CID:	103692900
Reduced:	N2O2F3C16H21 (1)
Stoich.:	A2B2C3D16E21 (1)
Weight, g/mol:	306.230728
ΔH_f, kcal/mol:	-237.67
Dipole, Da:	2.88
IP(EA), eV:	-9.26(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(cyclohex-3-en-1-ylamino)-8-azabicyclo[3.2.1]octane-8-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)NC2=C(C=C(C=C2F)F)F

DOS

IR

Vibrations