Geometry & MOs

Info

ID:	411274
PubChem CID:	135084087
Reduced:	NO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	182.13068
ΔH_f, kcal/mol:	-35.7
Dipole, Da:	4.0
IP(EA), eV:	-10.1(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-5-cyclohexylpent-4-enoic acid

Drug info:

PubChemData

Smile

C/C=C(/CCC(=O)O)\C1=CC=C(C=C1)C#N

DOS

IR

Vibrations