Geometry & MOs

Info

ID:	405050
PubChem CID:	135072363
Reduced:	NO6C17H23 (1)
Stoich.:	AB6C17D23 (1)
Weight, g/mol:	284.125988
ΔH_f, kcal/mol:	-246.28
Dipole, Da:	4.9
IP(EA), eV:	-8.63(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(4-methoxy-3-methoxycarbonyl-4-oxobutyl)cyclopent-2-en-1-yl]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(CC(=O)N(C)C1=CC=C(C=C1)OC)C(=O)OCC

DOS

IR

Vibrations