Geometry & MOs

Info

ID:	404824
PubChem CID:	135071367
Reduced:	OSF3C16H19 (1)
Stoich.:	ABC3D16E19 (1)
Weight, g/mol:	246.125594
ΔH_f, kcal/mol:	-172.2
Dipole, Da:	4.55
IP(EA), eV:	-9.12(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-1-phenyl-2-prop-2-enylpentane-1,3-dione

Drug info:

PubChemData

Smile

CC(C)C=C=C(C)[C@H](COC1=CC=C(C=C1)C(F)(F)F)S

DOS

IR

Vibrations