Geometry & MOs

Info

ID:	413618
PubChem CID:	135086567
Reduced:	NOH13C14 (1)
Stoich.:	ABC13D14 (1)
Weight, g/mol:	326.02983
ΔH_f, kcal/mol:	22.92
Dipole, Da:	3.73
IP(EA), eV:	-9.25(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,5Z)-3-chloro-4,5-diethyl-6-iodoocta-3,5-diene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=C)C(=O)N2C=CC=C2

DOS

IR

Vibrations