Geometry & MOs

Info

ID:	405353
PubChem CID:	135073580
Reduced:	OF3H11C16 (1)
Stoich.:	AB3C11D16 (1)
Weight, g/mol:	264.172545
ΔH_f, kcal/mol:	-102.01
Dipole, Da:	5.54
IP(EA), eV:	-8.91(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z,3S,4R)-1-[(4-methoxyphenyl)methoxy]-4-methylhept-5-en-3-ol

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C#CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations