Geometry & MOs

Info

ID:	199092
PubChem CID:	79196697
Reduced:	N3O3C13H21 (1)
Stoich.:	A3B3C13D21 (1)
Weight, g/mol:	351.98394
ΔH_f, kcal/mol:	-109.62
Dipole, Da:	5.75
IP(EA), eV:	-8.51(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-4-iodophenyl)-2-methyl-3-(methylamino)propanamide

Drug info:

PubChemData

Smile

CC(CNC)C(=O)NC1=CN(C(=O)C=C1)CCOC

DOS

IR

Vibrations