Geometry & MOs

Info

ID:	322200
PubChem CID:	126669200
Reduced:	NF4O4H11C12 (1)
Stoich.:	AB4C4D11E12 (1)
Weight, g/mol:	377.221561
ΔH_f, kcal/mol:	-349.87
Dipole, Da:	6.68
IP(EA), eV:	-10.08(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(4-azidophenyl)ethyl]piperidin-4-yl]-N-phenylpropanamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](C(=O)N1)C(=O)O)C2C(C=C(C=C2F)OC(F)F)F

DOS

IR

Vibrations