Geometry & MOs

Info

ID:	320249
PubChem CID:	126658975
Reduced:	Cl2N3O4C30H39 (1)
Stoich.:	A2B3C4D30E39 (1)
Weight, g/mol:	408.396731
ΔH_f, kcal/mol:	-169.37
Dipole, Da:	4.66
IP(EA), eV:	-8.58(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-5-methylnon-6-en-3-yl] 2-heptyldecanoate

Drug info:

PubChemData

Smile

CC(C)CC(C)OC(=O)N1C(=O)CCC2=C1C=C(C=C2)OCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl

DOS

IR

Vibrations