Geometry & MOs

Info

ID:	446722
PubChem CID:	135277175
Reduced:	SF3O4C6H9 (1)
Stoich.:	AB3C4D6E9 (1)
Weight, g/mol:	607.247107
ΔH_f, kcal/mol:	-327.64
Dipole, Da:	2.45
IP(EA), eV:	-10.05(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl N-[1-[[1-(2-acetamidonaphthalen-1-yl)naphthalen-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

C[C@H](COS(=O)C(F)(F)F)C(=O)OC

DOS

IR

Vibrations