Geometry & MOs

Info

ID:	231508
PubChem CID:	87573968
Reduced:	NO5C28H31 (1)
Stoich.:	AB5C28D31 (1)
Weight, g/mol:	186.209599
ΔH_f, kcal/mol:	-159.6
Dipole, Da:	3.69
IP(EA), eV:	-8.54(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N',1-N'-diethyl-1-N-pentylethane-1,1-diamine

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=C(C=C1)C(=C3N2CC(COC4=CC=CC=C43)(CCC=O)O)C5CCCCC5

DOS

IR

Vibrations