Geometry & MOs

Info

ID:	150283
PubChem CID:	53789971
Reduced:	ClN2O4C21H21 (1)
Stoich.:	AB2C4D21E21 (1)
Weight, g/mol:	172.109944
ΔH_f, kcal/mol:	-92.55
Dipole, Da:	3.1
IP(EA), eV:	-8.9(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hydroxyethyl cyclohexanecarboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC4=C(C=C3)C(=CO4)O

DOS

IR

Vibrations