Geometry & MOs

Info

ID:	395020
PubChem CID:	135024456
Reduced:	NY2C12H17 (1)
Stoich.:	AB2C12D17 (1)
Weight, g/mol:	432.94002
ΔH_f, kcal/mol:	293.49
Dipole, Da:	4.94
IP(EA), eV:	-4.8(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(benzenesulfonyl)-N-(4-chloro-2-iodophenyl)propan-2-imine

Drug info:

PubChemData

Smile

CC(C)N(C1=[C-]C=CC=[C-]1)C(C)C.[Y].[Y]

DOS

IR

Vibrations