Geometry & MOs

Info

ID:	423369
PubChem CID:	135119385
Reduced:	FSO3N4C16H21 (1)
Stoich.:	ABC3D4E16F21 (1)
Weight, g/mol:	366.18559
ΔH_f, kcal/mol:	-120.3
Dipole, Da:	7.02
IP(EA), eV:	-9.42(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(3-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-N-methyl-1-(1-phenylpyrrolidin-3-yl)methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations