Geometry & MOs

Info

ID:	339722
PubChem CID:	127261724
Reduced:	Cl2N2O4C13H16 (1)
Stoich.:	A2B2C4D13E16 (1)
Weight, g/mol:	362.080013
ΔH_f, kcal/mol:	-146.41
Dipole, Da:	2.46
IP(EA), eV:	-9.34(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,4-dichlorophenoxy)acetyl]hexyl N-aminocarbamate

Drug info:

PubChemData

Smile

CCC(COC(=O)NN)C(=O)COC1=C(C=C(C=C1)Cl)Cl

DOS

IR

Vibrations