Geometry & MOs

Info

ID:	240800
PubChem CID:	93617632
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	240.093249
ΔH_f, kcal/mol:	-63.44
Dipole, Da:	3.58
IP(EA), eV:	-9.44(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,6S)-2,6-dimethylmorpholin-4-yl]-(4-methyl-1,3-thiazol-5-yl)methanone

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@H](O1)C)C(=O)CCC2=NC(=NO2)CC3=CC=CC=C3

DOS

IR

Vibrations