Geometry & MOs

Info

ID:	272930
PubChem CID:	103767915
Reduced:	NO2C14H19 (1)
Stoich.:	AB2C14D19 (1)
Weight, g/mol:	283.097521
ΔH_f, kcal/mol:	-95.23
Dipole, Da:	2.66
IP(EA), eV:	-9.46(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-chloro-5-methylanilino)-3,3-dimethyl-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)C(=O)N2CCC(CC2)O

DOS

IR

Vibrations