Geometry & MOs

Info

ID:	37368
PubChem CID:	8020252
Reduced:	NO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	272.116092
ΔH_f, kcal/mol:	-151.68
Dipole, Da:	6.46
IP(EA), eV:	-9.26(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2-cyanoanilino)-2-oxoethyl] cyclopentanecarboxylate

Drug info:

PubChemData

Smile

C[C@H]1C[C@H]1C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C

DOS

IR

Vibrations