Geometry & MOs

Info

ID:	49396
PubChem CID:	11532966
Reduced:	O3N7C25H27 (1)
Stoich.:	A3B7C25D27 (1)
Weight, g/mol:	473.232599
ΔH_f, kcal/mol:	-16.31
Dipole, Da:	6.9
IP(EA), eV:	-8.41(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-3-cyclohexyl-1-oxo-1-pyrrolidin-1-ylpropan-2-yl] N-[(2S)-1-(6-fluoro-1,3-benzoxazol-2-yl)-1-oxobutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CN1C=C2C=CC(=CC2=N1)NC(=O)C3=CC=CC=C3NCC4=CC(=NC=C4)NC(=O)N(C)CCO

DOS

IR

Vibrations