Geometry & MOs

Info

ID:	292031
PubChem CID:	114147650
Reduced:	ClNOC15H28 (1)
Stoich.:	ABCD15E28 (1)
Weight, g/mol:	408.92667
ΔH_f, kcal/mol:	-118.73
Dipole, Da:	5.38
IP(EA), eV:	-9.78(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dibromo-N-[(3-chlorocyclohexyl)methyl]benzamide

Drug info:

PubChemData

Smile

CCCC(CCC)C(=O)NCC1CCCC(C1)Cl

DOS

IR

Vibrations