Geometry & MOs

Info

ID:	402703
PubChem CID:	135056955
Reduced:	OC10H16 (1)
Stoich.:	AB10C16 (1)
Weight, g/mol:	206.13068
ΔH_f, kcal/mol:	-27.8
Dipole, Da:	4.13
IP(EA), eV:	-9.87(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2S)-3-(methoxymethyl)-2-methyl-1-phenylbut-3-en-1-ol

Drug info:

PubChemData

Smile

CCCC/C=C\C/C=C/C=O

DOS

IR

Vibrations