Geometry & MOs

Info

ID:	265432
PubChem CID:	103520280
Reduced:	SN2O2C6H8 (1)
Stoich.:	AB2C2D6E8 (1)
Weight, g/mol:	350.98869
ΔH_f, kcal/mol:	-56.03
Dipole, Da:	4.94
IP(EA), eV:	-9.22(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-iodophenyl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CC1=COC(=N1)SCC(=O)N

DOS

IR

Vibrations