Geometry & MOs

Info

ID:	322688
PubChem CID:	126670819
Reduced:	INO3C5H8 (1)
Stoich.:	ABC3D5E8 (1)
Weight, g/mol:	141.115364
ΔH_f, kcal/mol:	-122.11
Dipole, Da:	3.51
IP(EA), eV:	-10.18(-2.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,3R,5R)-2,3-dimethyl-2-azabicyclo[3.2.0]heptan-6-ol

Drug info:

PubChemData

Smile

CC(=O)NCCOC(=O)I

DOS

IR

Vibrations