Geometry & MOs

Info

ID:	57125
PubChem CID:	22395367
Reduced:	NOC10H17 (1)
Stoich.:	ABC10D17 (1)
Weight, g/mol:	154.062994
ΔH_f, kcal/mol:	-26.62
Dipole, Da:	1.17
IP(EA), eV:	-9.15(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-oxocyclohexylidene)acetic acid

Drug info:

PubChemData

Smile

CON=C1C2CCCC1CCC2

DOS

IR

Vibrations