Geometry & MOs

Info

ID:	399109
PubChem CID:	135037829
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	235.138385
ΔH_f, kcal/mol:	-133.0
Dipole, Da:	1.9
IP(EA), eV:	-9.67(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,2-difluoro-4-methyl-3-(prop-2-enylamino)pentanoate

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1CCO)C)C(=O)CC2O

DOS

IR

Vibrations