Geometry & MOs

Info

ID:	399695
PubChem CID:	135041826
Reduced:	O2C9H10 (1)
Stoich.:	A2B9C10 (1)
Weight, g/mol:	266.167065
ΔH_f, kcal/mol:	-10.64
Dipole, Da:	2.45
IP(EA), eV:	-10.07(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-cyclohexyl-7-phenylhepta-2,4-diyn-1-ol

Drug info:

PubChemData

Smile

CC(=O)OCCCC#CC#C

DOS

IR

Vibrations