Geometry & MOs

Info

ID:	282360
PubChem CID:	103923411
Reduced:	NO4C13H19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	271.070071
ΔH_f, kcal/mol:	-151.85
Dipole, Da:	1.82
IP(EA), eV:	-9.0(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[5-[(thiolan-3-ylamino)methyl]thiophen-2-yl]acetate

Drug info:

PubChemData

Smile

COC(=O)C1=C(C=CO1)CNC2CCCC2CO

DOS

IR

Vibrations