Geometry & MOs

Info

ID:	45684
PubChem CID:	10516497
Reduced:	ClN4C14H15 (1)
Stoich.:	AB4C14D15 (1)
Weight, g/mol:	274.09323
ΔH_f, kcal/mol:	56.09
Dipole, Da:	2.15
IP(EA), eV:	-8.68(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-bromo-2-(2-methylprop-2-enoxymethyl)oct-1-ene

Drug info:

PubChemData

Smile

CC1=CC(=C(C2=C(C=CN=C12)Cl)C)NC3=NCCN3

DOS

IR

Vibrations