Geometry & MOs

Info

ID:	43986
PubChem CID:	10322713
Reduced:	OF2N3C29H31 (1)
Stoich.:	AB2C3D29E31 (1)
Weight, g/mol:	475.279469
ΔH_f, kcal/mol:	-50.61
Dipole, Da:	3.52
IP(EA), eV:	-8.93(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2S,3S,5S)-5-[2-(5-amino-1,2,4-oxadiazol-3-yl)ethylcarbamoyl]-3-hydroxy-6-methyl-1-phenylheptan-2-yl]carbamate

Drug info:

PubChemData

Smile

CN(C)C(=O)N1CC(=CC1(CCCNCC2=CC=CC=C2)C3=CC=CC=C3)C4=C(C=CC(=C4)F)F

DOS

IR

Vibrations