Geometry & MOs

Info

ID:	159468
PubChem CID:	57280273
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	480.490631
ΔH_f, kcal/mol:	-42.8
Dipole, Da:	3.09
IP(EA), eV:	-8.96(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,8-diethylundecyl 2-heptyldecanoate

Drug info:

PubChemData

Smile

CC(C)OCC(C)C(=O)N(C1=CC=CC=C1)C2=CC=CC=N2

DOS

IR

Vibrations