Geometry & MOs

Info

ID:	389681
PubChem CID:	134994437
Reduced:	ClNO2C8H10 (1)
Stoich.:	ABC2D8E10 (1)
Weight, g/mol:	221.087435
ΔH_f, kcal/mol:	-98.03
Dipole, Da:	3.85
IP(EA), eV:	-10.33(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S,4R)-2-bicyclo[2.2.1]heptanyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@@H](C(=O)O)[NH3+].[Cl-]

DOS

IR

Vibrations