Geometry & MOs

Info

ID:	292118
PubChem CID:	114465318
Reduced:	SN3O4C10H19 (1)
Stoich.:	AB3C4D10E19 (1)
Weight, g/mol:	240.102941
ΔH_f, kcal/mol:	-175.27
Dipole, Da:	6.1
IP(EA), eV:	-9.66(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-1-N-[2-(2-methylprop-2-enoxy)ethyl]benzene-1,4-diamine

Drug info:

PubChemData

Smile

COC(=O)NS(=O)(=O)N1CC2CCCC(C2C1)N

DOS

IR

Vibrations