Geometry & MOs

Info

ID:	362659
PubChem CID:	127309023
Reduced:	SN3O4C13H19 (1)
Stoich.:	AB3C4D13E19 (1)
Weight, g/mol:	338.195405
ΔH_f, kcal/mol:	-129.23
Dipole, Da:	2.22
IP(EA), eV:	-9.31(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1,4-dioxan-2-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)NCC2COCCO2)C3=NC=CS3

DOS

IR

Vibrations