Geometry & MOs

Info

ID:	148443
PubChem CID:	53788105
Reduced:	ClO3H5C10 (1)
Stoich.:	AB3C5D10 (1)
Weight, g/mol:	273.136493
ΔH_f, kcal/mol:	-74.77
Dipole, Da:	2.55
IP(EA), eV:	-10.29(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(cyclohexylcarbamoyl)phenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

C1C(=O)C2=C(C=C(C=C2)Cl)C(=O)C1=O

DOS

IR

Vibrations