Geometry & MOs

Info

ID:	380122
PubChem CID:	134965059
Reduced:	OC14H14 (1)
Stoich.:	AB14C14 (1)
Weight, g/mol:	265.077265
ΔH_f, kcal/mol:	26.29
Dipole, Da:	0.66
IP(EA), eV:	-9.23(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1R,3S,3aR,6aS)-6-oxo-1-thiophen-2-yl-2,3,3a,4,5,6a-hexahydro-1H-cyclopenta[c]pyrrole-3-carboxylate

Drug info:

PubChemData

Smile

C[C@](C=C)(C1=CC=CC=C1)C2=COC=C2

DOS

IR

Vibrations