Geometry & MOs

Info

ID:	132146
PubChem CID:	51313526
Reduced:	SN2O4C20H20 (1)
Stoich.:	AB2C4D20E20 (1)
Weight, g/mol:	315.140533
ΔH_f, kcal/mol:	-105.28
Dipole, Da:	8.08
IP(EA), eV:	-9.52(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-(2-phenylpyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CN2C(=C)C3=CC=CC=C3C2=O

DOS

IR

Vibrations