Geometry & MOs

Info

ID:	403938
PubChem CID:	135062676
Reduced:	SiO2C29H52 (1)
Stoich.:	AB2C29D52 (1)
Weight, g/mol:	250.172151
ΔH_f, kcal/mol:	-188.18
Dipole, Da:	2.8
IP(EA), eV:	-8.59(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3S)-3-[2-(cyclohexen-1-yl)ethynyl]pent-4-enyl]benzene

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C)O/C=C/CO[Si](C(C)C)(C(C)C)C(C)C

DOS

IR

Vibrations