Geometry & MOs

Info

ID:	379169
PubChem CID:	134356418
Reduced:	ON8C19H24 (1)
Stoich.:	AB8C19D24 (1)
Weight, g/mol:	198.117528
ΔH_f, kcal/mol:	56.9
Dipole, Da:	6.34
IP(EA), eV:	-8.28(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z,6E)-7-chloro-4-propylnona-1,4,6-triene

Drug info:

PubChemData

Smile

CC1(C2=CCC(C=C2NC1=O)NC3=NN4C=CN=C(C4=N3)N5CC[C@@H](C5)N)C

DOS

IR

Vibrations