Geometry & MOs

Info

ID:	445546
PubChem CID:	135267932
Reduced:	SF3O4N8C26H29 (1)
Stoich.:	AB3C4D8E26F29 (1)
Weight, g/mol:	372.179755
ΔH_f, kcal/mol:	-213.68
Dipole, Da:	12.21
IP(EA), eV:	-8.36(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-amino-1-oxo-4-phenylbutan-2-yl]-5-(morpholin-4-ylmethyl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CCS(=O)(=O)N1CCN(CC1)C2=NC(=C(C=C2)NC3=NC=C(C(=N3)NC4=CC(=CC=C4)NC(=O)C=C)C(F)(F)F)OC

DOS

IR

Vibrations