Geometry & MOs

Info

ID:	351979
PubChem CID:	127282897
Reduced:	O3N5C20H35 (1)
Stoich.:	A3B5C20D35 (1)
Weight, g/mol:	244.124549
ΔH_f, kcal/mol:	-160.51
Dipole, Da:	4.68
IP(EA), eV:	-9.15(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)NCC(=O)N3CCCCC3

DOS

IR

Vibrations