Geometry & MOs

Info

ID:	212136
PubChem CID:	81059585
Reduced:	O2N3C15H25 (1)
Stoich.:	A2B3C15D25 (1)
Weight, g/mol:	257.162708
ΔH_f, kcal/mol:	-76.34
Dipole, Da:	5.1
IP(EA), eV:	-8.74(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-ethoxyethyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid

Drug info:

PubChemData

Smile

CCOCCN(C)C(C)C(=O)NC1=CC=C(C=C1)CN

DOS

IR

Vibrations