Geometry & MOs

Info

ID:	179725
PubChem CID:	76522314
Reduced:	NF2O3C23H25 (1)
Stoich.:	AB2C3D23E25 (1)
Weight, g/mol:	302.139233
ΔH_f, kcal/mol:	-155.38
Dipole, Da:	7.08
IP(EA), eV:	-9.55(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

N-tert-butyl-N-[1-(5-oxo-2H-furan-2-yl)-2-phenylethyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)N(C(CC1=CC=CC=C1)C(C(C#CC2=CC=CC=C2)(F)F)O)C(=O)O

DOS

IR

Vibrations