Geometry & MOs

Info

ID:	224994
PubChem CID:	85735435
Reduced:	O4C17H26 (1)
Stoich.:	A4B17C26 (1)
Weight, g/mol:	307.189592
ΔH_f, kcal/mol:	-188.76
Dipole, Da:	3.25
IP(EA), eV:	-9.02(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[5-(1-azido-5-methylhexyl)furan-2-yl]butanoate

Drug info:

PubChemData

Smile

CCCCCC(C1=CC=C(C=C1)OCCCC(=O)OC)O

DOS

IR

Vibrations