Geometry & MOs

Info

ID:	376706
PubChem CID:	134222730
Reduced:	NPO4F5H15C17 (1)
Stoich.:	ABC4D5E15F17 (1)
Weight, g/mol:	195.1987
ΔH_f, kcal/mol:	-403.05
Dipole, Da:	3.61
IP(EA), eV:	-9.65(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2,3-ditert-butyl-2-azabicyclo[3.1.0]hexane

Drug info:

PubChemData

Smile

CC(C)OC(=O)CN[P@@](=O)(C1=C(C(=C(C(=C1F)F)F)F)F)OC2=CC=CC=C2

DOS

IR

Vibrations