Geometry & MOs

Info

ID:	285223
PubChem CID:	104098728
Reduced:	ON4C11H20 (1)
Stoich.:	AB4C11D20 (1)
Weight, g/mol:	260.083078
ΔH_f, kcal/mol:	-26.85
Dipole, Da:	3.28
IP(EA), eV:	-8.75(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(5-nitrothiophen-2-yl)methylamino]propoxy]ethanol

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N)NCC1=CN(N=C1)CC(C)C

DOS

IR

Vibrations