Geometry & MOs

Info

ID:	407312
PubChem CID:	135079779
Reduced:	NSO2H13C17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	339.183444
ΔH_f, kcal/mol:	12.39
Dipole, Da:	3.16
IP(EA), eV:	-9.0(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-benzyl-3-(N-methylanilino)-3-oxopropanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)/N=C\C2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations