Geometry & MOs

Info

ID:	390363
PubChem CID:	134998702
Reduced:	NSO2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	267.1293
ΔH_f, kcal/mol:	-60.76
Dipole, Da:	3.55
IP(EA), eV:	-8.23(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (1E)-N-[(R)-tert-butylsulfinyl]-3-phenylpropanimidate

Drug info:

PubChemData

Smile

CC(C)(C)[S@@](=O)/N=C(\CC1=CC=CC=C1)/OC

DOS

IR

Vibrations