Geometry & MOs

Info

ID:	363228
PubChem CID:	127310369
Reduced:	F3N3O4C12H18 (1)
Stoich.:	A3B3C4D12E18 (1)
Weight, g/mol:	324.179755
ΔH_f, kcal/mol:	-333.03
Dipole, Da:	1.83
IP(EA), eV:	-9.65(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(C(=O)C1NC(=O)NCC2COCCO2)CC(F)(F)F

DOS

IR

Vibrations