Geometry & MOs

Info

ID:	126277
PubChem CID:	50958077
Reduced:	ON3C8H10 (2)
Stoich.:	AB3C8D10 (2)
Weight, g/mol:	330.137971
ΔH_f, kcal/mol:	37.42
Dipole, Da:	1.24
IP(EA), eV:	-8.49(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-2-[[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]amino]-2-phenylacetate

Drug info:

PubChemData

Smile

CCC1=NOC(=N1)CN(CC)C(=O)C2=CC(=NN2)C3=CC=CN3C

DOS

IR

Vibrations