Geometry & MOs

Info

ID:	216655
PubChem CID:	85086566
Reduced:	SiO4C14H28 (1)
Stoich.:	AB4C14D28 (1)
Weight, g/mol:	288.245316
ΔH_f, kcal/mol:	-251.53
Dipole, Da:	1.47
IP(EA), eV:	-8.93(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5,9a-dimethyl-7-propan-2-yl-1,2,3,3a,4,6a,7,8,9,9b-decahydrocyclopenta[e]azulen-3-yl)ethanone

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OC(CC(C=C)O)CC(=O)OC

DOS

IR

Vibrations