Geometry & MOs

Info

ID:	276348
PubChem CID:	103822331
Reduced:	OSN3C12H19 (1)
Stoich.:	ABC3D12E19 (1)
Weight, g/mol:	364.96795
ΔH_f, kcal/mol:	-33.57
Dipole, Da:	2.89
IP(EA), eV:	-9.25(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-2-iodophenyl)oxane-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=CN=C(S1)CNC(=O)C2CNCC2C

DOS

IR

Vibrations