Geometry & MOs

Info

ID:	352093
PubChem CID:	127283161
Reduced:	N2O2C10H15 (2)
Stoich.:	A2B2C10D15 (2)
Weight, g/mol:	258.140199
ΔH_f, kcal/mol:	-167.36
Dipole, Da:	4.09
IP(EA), eV:	-8.39(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-(oxan-4-ylmethyl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1COCCC1(CNC(=O)NCCC(=O)N2CCN(CC2)C3=CC=CC=C3)O

DOS

IR

Vibrations