Geometry & MOs

Info

ID:	281368
PubChem CID:	103913771
Reduced:	SN2O2C10H16 (1)
Stoich.:	AB2C2D10E16 (1)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	-63.49
Dipole, Da:	3.63
IP(EA), eV:	-9.34(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-1-phenylethanamine

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)NCCS(=O)(=O)N

DOS

IR

Vibrations