Geometry & MOs

Info

ID:	314029
PubChem CID:	126619763
Reduced:	NO7C25H41 (1)
Stoich.:	AB7C25D41 (1)
Weight, g/mol:	260.162374
ΔH_f, kcal/mol:	-338.09
Dipole, Da:	5.12
IP(EA), eV:	-8.78(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 3-(2-butoxy-2-oxoethoxy)propanoate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)OCCCOCCCOCC(=O)OCC(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations