Geometry & MOs

Info

ID:	53078
PubChem CID:	14709527
Reduced:	O4N5C20H43 (1)
Stoich.:	A4B5C20D43 (1)
Weight, g/mol:	194.13068
ΔH_f, kcal/mol:	-164.19
Dipole, Da:	6.51
IP(EA), eV:	-8.45(1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(furan-2-yl)-2-propylpentan-1-one

Drug info:

PubChemData

Smile

C1CNCCN2CCOCCOCCN(CCNCCN1)CCOCCOCC2

DOS

IR

Vibrations