Geometry & MOs

Info

ID:	372701
PubChem CID:	131302833
Reduced:	O2N3C10H11 (1)
Stoich.:	A2B3C10D11 (1)
Weight, g/mol:	224.098334
ΔH_f, kcal/mol:	18.23
Dipole, Da:	3.92
IP(EA), eV:	-9.89(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-pyrrolidin-1-yl-3-thiophen-2-ylpropan-1-one

Drug info:

PubChemData

Smile

CN(CC#N)C1CCC2=C(C1=O)C=NO2

DOS

IR

Vibrations