Geometry & MOs

Info

ID:	345092
PubChem CID:	127268852
Reduced:	S2O4N5C13H19 (1)
Stoich.:	A2B4C5D13E19 (1)
Weight, g/mol:	292.145678
ΔH_f, kcal/mol:	-97.6
Dipole, Da:	9.51
IP(EA), eV:	-9.43(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methylmorpholin-2-yl)methyl]-1-(oxan-2-yl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(C=N2)S(=O)(=O)NCCN3CCCS3(=O)=O)C

DOS

IR

Vibrations