Geometry & MOs

Info

ID:	368788
PubChem CID:	127330118
Reduced:	SN3O5C18H27 (1)
Stoich.:	AB3C5D18E27 (1)
Weight, g/mol:	257.162708
ΔH_f, kcal/mol:	-185.26
Dipole, Da:	3.31
IP(EA), eV:	-8.64(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-2-ylmethyl)-2-(oxolan-3-ylmethoxy)acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)COCC3CCOC3

DOS

IR

Vibrations