Geometry & MOs

Info

ID:	274136
PubChem CID:	103807264
Reduced:	ON2C16H26 (1)
Stoich.:	AB2C16D26 (1)
Weight, g/mol:	392.01524
ΔH_f, kcal/mol:	-39.95
Dipole, Da:	2.6
IP(EA), eV:	-9.29(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(aminomethyl)cyclohexyl]-3-chloro-4-iodobenzamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)CN)NC(=O)C2C3C2C4CCC3C4

DOS

IR

Vibrations