Geometry & MOs

Info

ID:	265327
PubChem CID:	103517317
Reduced:	F2O2C7H10 (1)
Stoich.:	A2B2C7D10 (1)
Weight, g/mol:	213.136493
ΔH_f, kcal/mol:	-187.26
Dipole, Da:	3.55
IP(EA), eV:	-9.35(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-4-(3-methylbut-2-enylamino)-4-oxobutanoic acid

Drug info:

PubChemData

Smile

C1CC(=COC1)C(C(F)F)O

DOS

IR

Vibrations