Geometry & MOs

Info

ID:	318714
PubChem CID:	126652805
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	196.182715
ΔH_f, kcal/mol:	-93.62
Dipole, Da:	2.41
IP(EA), eV:	-9.37(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylidene-4-(2,3,3-trimethylbutan-2-yl)oxane

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC(=C1)/C=C/C(=O)OC(C)(C)C

DOS

IR

Vibrations