Geometry & MOs

Info

ID:	48955
PubChem CID:	11528518
Reduced:	OC6H10 (2)
Stoich.:	AB6C10 (2)
Weight, g/mol:	197.080041
ΔH_f, kcal/mol:	-114.45
Dipole, Da:	1.8
IP(EA), eV:	-9.69(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (3aS,7aR)-2-amino-5,7a-dihydro-3aH-[1,3]oxazolo[4,5-b]pyridine-4-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@H](C(=O)C1)C(C)(C)CC=O

DOS

IR

Vibrations