Geometry & MOs

Info

ID:	159418
PubChem CID:	57280118
Reduced:	C9H14 (1)
Stoich.:	A9B14 (1)
Weight, g/mol:	360.214803
ΔH_f, kcal/mol:	48.14
Dipole, Da:	1.53
IP(EA), eV:	-7.94(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(1-carboxypentoxy)-1-oxohexan-2-yl]oxyhexanoic acid

Drug info:

PubChemData

Smile

CC1=C2CCC(C1)(C2)C

DOS

IR

Vibrations