Geometry & MOs

Info

ID:	306836
PubChem CID:	125258714
Reduced:	O2N4H16C17 (1)
Stoich.:	A2B4C16D17 (1)
Weight, g/mol:	290.108899
ΔH_f, kcal/mol:	-12.25
Dipole, Da:	5.66
IP(EA), eV:	-9.06(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,6aR)-1-(2-cyclopropylacetyl)-4-thiophen-3-yl-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one

Drug info:

PubChemData

Smile

C1CN([C@@H]2[C@H]1N(C(=O)C2)C3=CN=CC=C3)C(=O)C4=CC=CC=N4

DOS

IR

Vibrations