Geometry & MOs

Info

ID:	306879
PubChem CID:	125264158
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-48.98
Dipole, Da:	4.79
IP(EA), eV:	-9.21(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3aR,6aR)-5-oxo-4-(pyridin-3-ylmethyl)-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-1-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1CC[C@H]2[C@@H]1CC(=O)N2CC3=CN=CC=C3

DOS

IR

Vibrations