Geometry & MOs

Info

ID:	20056
PubChem CID:	577871
Reduced:	ClNO3C16H20 (1)
Stoich.:	ABC3D16E20 (1)
Weight, g/mol:	309.113171
ΔH_f, kcal/mol:	-128.32
Dipole, Da:	4.39
IP(EA), eV:	-9.69(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-chloro-1-(1-phenylethylcarbamoyl)cyclobutane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CC(C1)Cl)C(=O)NC(C)C2=CC=CC=C2

DOS

IR

Vibrations