Geometry & MOs

Info

ID:	370924
PubChem CID:	127341326
Reduced:	SO2N3C9H17 (1)
Stoich.:	AB2C3D9E17 (1)
Weight, g/mol:	215.134385
ΔH_f, kcal/mol:	-100.78
Dipole, Da:	1.93
IP(EA), eV:	-8.79(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(oxan-2-ylmethyl)thiomorpholine

Drug info:

PubChemData

Smile

CC1CSCCN1CC(=O)NC(=O)NC

DOS

IR

Vibrations