Geometry & MOs

Info

ID:	167833
PubChem CID:	74883829
Reduced:	OCl2N2C13H14 (1)
Stoich.:	AB2C2D13E14 (1)
Weight, g/mol:	222.082684
ΔH_f, kcal/mol:	-34.38
Dipole, Da:	5.37
IP(EA), eV:	-9.11(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-aminocyclobutyl)-3-thiophen-2-ylprop-2-enamide

Drug info:

PubChemData

Smile

C1CN(C2C1CNC2)C(=O)C3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations