Geometry & MOs

Info

ID:	402748
PubChem CID:	135057126
Reduced:	IO2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	202.135765
ΔH_f, kcal/mol:	-37.78
Dipole, Da:	1.82
IP(EA), eV:	-9.72(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-[(2R)-but-3-en-2-yl]-3,4-dihydro-2H-naphthalen-1-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC[C@H](C=O)I

DOS

IR

Vibrations