Geometry & MOs

Info

ID:	406658
PubChem CID:	135078267
Reduced:	O2C15H18 (1)
Stoich.:	A2B15C18 (1)
Weight, g/mol:	270.16198
ΔH_f, kcal/mol:	-27.45
Dipole, Da:	3.73
IP(EA), eV:	-8.31(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-pyran-6-yl)-2-[(4-methylphenyl)methylidene]pentan-1-one

Drug info:

PubChemData

Smile

C/C(=C\CC1=C(C=CC(=C1)OC)O)/CCC#C

DOS

IR

Vibrations