Geometry & MOs

Info

ID:	74898
PubChem CID:	48422664
Reduced:	N2O5C19H28 (1)
Stoich.:	A2B5C19D28 (1)
Weight, g/mol:	390.141342
ΔH_f, kcal/mol:	-166.83
Dipole, Da:	2.94
IP(EA), eV:	-8.73(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-(4-fluorophenyl)sulfanylpropylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C(C)OCC2CC2)OC

DOS

IR

Vibrations