Geometry & MOs

Info

ID:	365760
PubChem CID:	127318485
Reduced:	O3N4C17H26 (1)
Stoich.:	A3B4C17D26 (1)
Weight, g/mol:	351.198048
ΔH_f, kcal/mol:	-70.48
Dipole, Da:	2.04
IP(EA), eV:	-9.12(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-propan-2-yl-N-[(1-thiomorpholin-4-ylcyclohexyl)methyl]-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)C(C)N2CCN(CC2)C(=O)C3CC4CCC3O4

DOS

IR

Vibrations