Geometry & MOs

Info

ID:	310751
PubChem CID:	126587233
Reduced:	NOC8H16 (2)
Stoich.:	ABC8D16 (2)
Weight, g/mol:	346.199153
ΔH_f, kcal/mol:	-156.07
Dipole, Da:	2.69
IP(EA), eV:	-9.73(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aS,6aS)-6-butoxy-5-(butoxymethyl)-2,2-dimethyl-6,6a-dihydro-3aH-furo[2,3-d][1,3]dioxole-5-carboxylic acid

Drug info:

PubChemData

Smile

CCCCC(=O)NCCCNC(=O)CCCCC(C)C

DOS

IR

Vibrations