Geometry & MOs

Info

ID:	352825
PubChem CID:	127283915
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	382.149718
ΔH_f, kcal/mol:	-47.87
Dipole, Da:	6.78
IP(EA), eV:	-8.51(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2-[2-(thiomorpholine-4-carbonyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=CN2C(=NC(=CC2=O)CN3CCCC3C(=O)N4CCSCC4)C=C1

DOS

IR

Vibrations