Geometry & MOs

Info

ID:	186767
PubChem CID:	77480789
Reduced:	N2F3C20H33 (1)
Stoich.:	A2B3C20D33 (1)
Weight, g/mol:	455.216869
ΔH_f, kcal/mol:	-186.39
Dipole, Da:	4.61
IP(EA), eV:	-8.78(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[2-[(6-cyclohexa-1,5-dien-1-ylimidazo[2,1-b][1,3]oxazol-2-yl)carbamoyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCCCCCC(C1=C(C=C(C(C1)C)C(F)(F)F)C)N2CCNCC2

DOS

IR

Vibrations