Geometry & MOs

Info

ID:	289485
PubChem CID:	104357607
Reduced:	BrClNOSC15H15 (1)
Stoich.:	ABCDEF15G15 (1)
Weight, g/mol:	343.03385
ΔH_f, kcal/mol:	-7.5
Dipole, Da:	2.91
IP(EA), eV:	-9.21(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-2-chloro-N-(2,2-dimethylcyclohexyl)benzamide

Drug info:

PubChemData

Smile

CCCC(C1=CC=CS1)NC(=O)C2=C(C(=CC=C2)Br)Cl

DOS

IR

Vibrations