Geometry & MOs

Info

ID:	277130
PubChem CID:	103826885
Reduced:	BrClON2C13H16 (1)
Stoich.:	ABCD2E13F16 (1)
Weight, g/mol:	315.00255
ΔH_f, kcal/mol:	-22.38
Dipole, Da:	5.65
IP(EA), eV:	-9.22(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-cyclopropyl-N-propylbenzamide

Drug info:

PubChemData

Smile

CN(C)C1CCN(C1)C(=O)C2=CC(=CC(=C2)Br)Cl

DOS

IR

Vibrations