Geometry & MOs

Info

ID:	199171
PubChem CID:	79209333
Reduced:	NO4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	289.077265
ΔH_f, kcal/mol:	-125.95
Dipole, Da:	6.77
IP(EA), eV:	-9.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,3-dihydro-1-benzothiophene-2-carbonylamino)cyclopent-2-ene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1C(C=CC1NC(=O)COC2=CC=CC=C2)C(=O)O

DOS

IR

Vibrations