Geometry & MOs

Info

ID:	262184
PubChem CID:	103275828
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	299.155515
ΔH_f, kcal/mol:	-95.0
Dipole, Da:	3.9
IP(EA), eV:	-8.85(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[5-[[(1-ethoxy-3-methylbutan-2-yl)amino]methyl]thiophen-2-yl]acetate

Drug info:

PubChemData

Smile

C1CC(CC1CNCC2=C(C(=CC=C2)Cl)O)O

DOS

IR

Vibrations