Geometry & MOs

Info

ID:	339587
PubChem CID:	127261577
Reduced:	O4C19H34 (1)
Stoich.:	A4B19C34 (1)
Weight, g/mol:	266.22458
ΔH_f, kcal/mol:	-251.97
Dipole, Da:	1.22
IP(EA), eV:	-10.61(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethyl-5,5-dimethyl-2-bicyclo[2.2.1]heptanyl) hexanoate

Drug info:

PubChemData

Smile

CCCCCC(=O)OC1CCC(CC1CC)OC(=O)CCCC

DOS

IR

Vibrations