Geometry & MOs

Info

ID:	282103
PubChem CID:	103916113
Reduced:	NO2C8H14 (2)
Stoich.:	AB2C8D14 (2)
Weight, g/mol:	325.171165
ΔH_f, kcal/mol:	-197.26
Dipole, Da:	5.19
IP(EA), eV:	-9.57(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-ethyl-3-(2-thiophen-3-ylethoxy)pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC1(CCN(C1)C(=O)OC(C)(C)C)OCC(=O)NC2CC2

DOS

IR

Vibrations