Geometry & MOs

Info

ID:	188220
PubChem CID:	77682819
Reduced:	FN4O5C16H19 (1)
Stoich.:	AB4C5D16E19 (1)
Weight, g/mol:	337.171165
ΔH_f, kcal/mol:	-226.7
Dipole, Da:	3.68
IP(EA), eV:	-8.71(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(tert-butylsulfinylamino)-2-methyl-4-phenylpent-4-enoate

Drug info:

PubChemData

Smile

C1CN(C(CN1C2=CC(=CC=C2)N3CC(OC3=O)C(=O)N)F)C(=O)CO

DOS

IR

Vibrations