Geometry & MOs

Info

ID:	380364
PubChem CID:	134970789
Reduced:	OC21H36 (1)
Stoich.:	AB21C36 (1)
Weight, g/mol:	306.25588
ΔH_f, kcal/mol:	-73.58
Dipole, Da:	1.91
IP(EA), eV:	-8.94(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1S,4aR)-1,2,5,5-tetramethyl-2,3,4,4a,6,7-hexahydronaphthalen-1-yl]ethyl]-2-methyl-1,3-dioxolane

Drug info:

PubChemData

Smile

CC1CC[C@H]2C(=CCCC2(C)C)[C@@]1(C)CC/C(=C/COC)/C

DOS

IR

Vibrations