Geometry & MOs

Info

ID:	406484
PubChem CID:	135077804
Reduced:	SN5H19C21 (1)
Stoich.:	AB5C19D21 (1)
Weight, g/mol:	382.09243
ΔH_f, kcal/mol:	119.43
Dipole, Da:	5.23
IP(EA), eV:	-8.56(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z,6Z)-4-chloro-7-iodo-5,6-dipropyldeca-4,6-diene

Drug info:

PubChemData

Smile

C1CN(CCC1CC2=CC=CC=C2)C3=NC4=C(C=C3C#N)C(=C(S4)C#N)N

DOS

IR

Vibrations