Geometry & MOs

Info

ID:	419026
PubChem CID:	135107362
Reduced:	SO2N4C23H26 (1)
Stoich.:	AB2C4D23E26 (1)
Weight, g/mol:	359.166748
ΔH_f, kcal/mol:	12.39
Dipole, Da:	2.27
IP(EA), eV:	-8.88(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-benzylmorpholin-2-yl)-N-[(2-ethyl-1,3-thiazol-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)CN2[C@@H]3CC[C@H]2[C@@](C3)(CC4=CSC=N4)C(=O)NCC5=CC=CC=N5

DOS

IR

Vibrations