Geometry & MOs

Info

ID:	289391
PubChem CID:	104349201
Reduced:	ClSN3O3C11H14 (1)
Stoich.:	ABC3D3E11F14 (1)
Weight, g/mol:	271.153206
ΔH_f, kcal/mol:	-100.28
Dipole, Da:	6.15
IP(EA), eV:	-10.05(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(2-morpholin-2-ylacetyl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC(=O)NC1CCN(C1)S(=O)(=O)C2=CC(=NC=C2)Cl

DOS

IR

Vibrations