Geometry & MOs

Info

ID:	402615
PubChem CID:	135056585
Reduced:	SN2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	43.44
Dipole, Da:	2.6
IP(EA), eV:	-8.57(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-5-[(R)-hydroxy(phenyl)methyl]-5-methylpyrrolidin-2-one

Drug info:

PubChemData

Smile

C1CCN(C1)C2N=CC3=CC=CC=C3S2

DOS

IR

Vibrations