Geometry & MOs

Info

ID:	352030
PubChem CID:	127283098
Reduced:	OSN5C12H19 (1)
Stoich.:	ABC5D12E19 (1)
Weight, g/mol:	244.124549
ΔH_f, kcal/mol:	-5.51
Dipole, Da:	4.42
IP(EA), eV:	-8.8(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NCC2=NN=C3N2CCC3

DOS

IR

Vibrations