Geometry & MOs

Info

ID:	233934
PubChem CID:	92252597
Reduced:	NPO3C9H20 (1)
Stoich.:	ABC3D9E20 (1)
Weight, g/mol:	356.059756
ΔH_f, kcal/mol:	-206.4
Dipole, Da:	1.4
IP(EA), eV:	-9.65(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-chloro-4-[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl]thieno[3,2-b]pyrrole-5-carboxylate

Drug info:

PubChemData

Smile

CCOP(=O)(N1[C@@H](C1(C)C)C)OCC

DOS

IR

Vibrations