Geometry & MOs

Info

ID:	391689
PubChem CID:	135008341
Reduced:	O5C38H48 (1)
Stoich.:	A5B38C48 (1)
Weight, g/mol:	292.219101
ΔH_f, kcal/mol:	-129.66
Dipole, Da:	5.79
IP(EA), eV:	-8.77(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-(2,6-dimethylphenyl)hex-1-en-2-yl]-1,3-dimethylbenzene

Drug info:

PubChemData

Smile

CCCC/C=C(\C=C\COCC1=CC=CC=C1)/C(=C/CCOCC2=CC=C(C=C2)OC)/CCOCC3=CC=C(C=C3)OC

DOS

IR

Vibrations