Geometry & MOs

Info

ID:	315033
PubChem CID:	126624245
Reduced:	OC16H16 (1)
Stoich.:	AB16C16 (1)
Weight, g/mol:	246.198365
ΔH_f, kcal/mol:	18.86
Dipole, Da:	1.65
IP(EA), eV:	-8.64(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-2-methoxy-1-propan-2-yl-3-prop-1-enylbenzene

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CC2=CC=CC=C2)C=C

DOS

IR

Vibrations