Geometry & MOs

Info

ID:	263724
PubChem CID:	103392962
Reduced:	NO2C10H11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	355.108754
ΔH_f, kcal/mol:	-125.55
Dipole, Da:	4.2
IP(EA), eV:	-8.7(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[3-(5-chloro-2-cyanoanilino)cyclobutyl]carbamate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC=C1NC2CC(C2)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations