Geometry & MOs

Info

ID:	20941
PubChem CID:	586333
Reduced:	NO4C18H25 (1)
Stoich.:	AB4C18D25 (1)
Weight, g/mol:	319.178358
ΔH_f, kcal/mol:	-180.09
Dipole, Da:	4.03
IP(EA), eV:	-9.16(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-(4-methoxy-N-methylanilino)-2-oxoethyl]cyclohexyl]acetic acid

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)OC)C(=O)CC2(CCCCC2)CC(=O)O

DOS

IR

Vibrations