Geometry & MOs

Info

ID:	149070
PubChem CID:	53788741
Reduced:	NOC25H29 (1)
Stoich.:	ABC25D29 (1)
Weight, g/mol:	176.120115
ΔH_f, kcal/mol:	33.52
Dipole, Da:	3.02
IP(EA), eV:	-8.29(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-propan-2-yl-2-prop-2-enylphenol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)OCCCN3CC4CCC3CC4

DOS

IR

Vibrations