Geometry & MOs

Info

ID:	306700
PubChem CID:	125165384
Reduced:	ON5C18H25 (1)
Stoich.:	AB5C18D25 (1)
Weight, g/mol:	336.105625
ΔH_f, kcal/mol:	15.17
Dipole, Da:	3.93
IP(EA), eV:	-7.94(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-[(2-fluorophenoxy)methyl]-N-(thiadiazol-5-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1NC(=O)N(C)C[C@@H]2CCN(C2)C3=CC=CC=C3)C

DOS

IR

Vibrations