Geometry & MOs

Info

ID:	249638
PubChem CID:	103091058
Reduced:	OC10H20 (1)
Stoich.:	AB10C20 (1)
Weight, g/mol:	254.03063
ΔH_f, kcal/mol:	-77.9
Dipole, Da:	2.15
IP(EA), eV:	-9.52(1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2-bromo-4-methylphenyl)-3-methylbut-3-en-2-ol

Drug info:

PubChemData

Smile

CCC(CC)/C=C(/C)\C(C)O

DOS

IR

Vibrations