Geometry & MOs

Info

ID:	2528
PubChem CID:	7830
Reduced:	O3C22H42 (1)
Stoich.:	A3B22C42 (1)
Weight, g/mol:	354.313395
ΔH_f, kcal/mol:	-191.0
Dipole, Da:	2.86
IP(EA), eV:	-9.88(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 8-(3-octyloxiran-2-yl)octanoate

Drug info:

PubChemData

Smile

CCCCCCCCC1C(O1)CCCCCCCC(=O)OCCCC

DOS

IR

Vibrations