Geometry & MOs

Info

ID:	45863
PubChem CID:	10518333
Reduced:	OC10H14 (2)
Stoich.:	AB10C14 (2)
Weight, g/mol:	300.20893
ΔH_f, kcal/mol:	-114.48
Dipole, Da:	1.58
IP(EA), eV:	-8.66(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,8R,11R)-10,11-bis[(2-methylpropan-2-yl)oxy]tricyclo[6.3.1.02,7]dodeca-2,4,6,9-tetraene

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1OC(=O)C)[C@]3(CCCC([C@@H]3CC2)(C)C)C

DOS

IR

Vibrations