Geometry & MOs

Info

ID:	276666
PubChem CID:	103824636
Reduced:	BrClON2H8C14 (1)
Stoich.:	ABCD2E8F14 (1)
Weight, g/mol:	286.97125
ΔH_f, kcal/mol:	38.06
Dipole, Da:	3.42
IP(EA), eV:	-9.33(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-chlorophenyl)cyclobutanecarboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C#N)C(=O)NC2=CC(=C(C=C2)Br)Cl

DOS

IR

Vibrations