Geometry & MOs

Info

ID:	276798
PubChem CID:	103825268
Reduced:	NO2F4C9H15 (1)
Stoich.:	AB2C4D9E15 (1)
Weight, g/mol:	245.162708
ΔH_f, kcal/mol:	-313.46
Dipole, Da:	4.5
IP(EA), eV:	-10.43(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[(4-hydroxy-2,2-dimethylbutyl)amino]-4-oxobutanoate

Drug info:

PubChemData

Smile

CC(C)(CCO)CNC(=O)C(C(F)F)(F)F

DOS

IR

Vibrations