Geometry & MOs

Info

ID:	354962
PubChem CID:	127287823
Reduced:	O2N5C13H17 (1)
Stoich.:	A2B5C13D17 (1)
Weight, g/mol:	238.077599
ΔH_f, kcal/mol:	-34.01
Dipole, Da:	5.19
IP(EA), eV:	-9.18(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[(3-methylthiophen-2-yl)methyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N[C@H]1C(=O)N2CCN(CC2)C3=NC=CN=C3

DOS

IR

Vibrations