Geometry & MOs

Info

ID:	296254
PubChem CID:	117563555
Reduced:	NO3C13H17 (1)
Stoich.:	AB3C13D17 (1)
Weight, g/mol:	263.152144
ΔH_f, kcal/mol:	-136.15
Dipole, Da:	3.34
IP(EA), eV:	-8.79(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2,2-dimethyl-3-oxo-3-(2,4,6-trimethylanilino)propanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)CC(C)C(=O)O

DOS

IR

Vibrations