Geometry & MOs

Info

ID:	361556
PubChem CID:	127303748
Reduced:	FSN3O4C18H22 (1)
Stoich.:	ABC3D4E18F22 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-159.08
Dipole, Da:	4.62
IP(EA), eV:	-9.9(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(morpholin-4-ylmethyl)-N-(oxan-3-yl)benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)(C(=O)N2CCOC(C2)C#N)NS(=O)(=O)C3=CC=CC(=C3)F

DOS

IR

Vibrations