Geometry & MOs

Info

ID:	365712
PubChem CID:	127318437
Reduced:	N3O3C16H23 (1)
Stoich.:	A3B3C16D23 (1)
Weight, g/mol:	351.161663
ΔH_f, kcal/mol:	-86.5
Dipole, Da:	3.55
IP(EA), eV:	-9.97(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2(CCCCC2)NC(=O)C3CC4CCC3O4

DOS

IR

Vibrations