Geometry & MOs

Info

ID:	422150
PubChem CID:	135117296
Reduced:	ON2S2C13H20 (1)
Stoich.:	AB2C2D13E20 (1)
Weight, g/mol:	315.158292
ΔH_f, kcal/mol:	-19.67
Dipole, Da:	2.56
IP(EA), eV:	-8.82(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CCCC1=NC(=CS1)CNC(=O)CSCC2CC2

DOS

IR

Vibrations