Geometry & MOs

Info

ID:	268563
PubChem CID:	103600019
Reduced:	INO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	323.05209
ΔH_f, kcal/mol:	-77.22
Dipole, Da:	3.81
IP(EA), eV:	-9.14(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-(cyclohexen-1-yl)ethyl]-2-hydroxybenzamide

Drug info:

PubChemData

Smile

C1CCCC(CC1)NC(=O)C2=C(C=CC(=C2)I)O

DOS

IR

Vibrations