Geometry & MOs

Info

ID:	193363
PubChem CID:	78381677
Reduced:	O4N5C17H29 (1)
Stoich.:	A4B5C17D29 (1)
Weight, g/mol:	252.172545
ΔH_f, kcal/mol:	-192.45
Dipole, Da:	4.73
IP(EA), eV:	-9.37(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(5-ethyl-4-oxocyclopent-2-en-1-yl)octanoic acid

Drug info:

PubChemData

Smile

CC(=O)NC(C1CC(CC1N=C(N)N)C(=O)O)C(=O)N2CCCCCC2

DOS

IR

Vibrations