Geometry & MOs

Info

ID:	405794
PubChem CID:	135075455
Reduced:	O2C6H11 (2)
Stoich.:	A2B6C11 (2)
Weight, g/mol:	232.14633
ΔH_f, kcal/mol:	-219.19
Dipole, Da:	3.68
IP(EA), eV:	-9.75(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5R)-5-hydroxy-2,2-dimethyl-1-(3-methylphenyl)cyclopentane-1-carbaldehyde

Drug info:

PubChemData

Smile

CC(=O)OCCC1CCC(OC1)C(C)(C)O

DOS

IR

Vibrations