Geometry & MOs

Info

ID:	171407
PubChem CID:	75373816
Reduced:	ON5C18H25 (1)
Stoich.:	AB5C18D25 (1)
Weight, g/mol:	331.200825
ΔH_f, kcal/mol:	54.1
Dipole, Da:	4.79
IP(EA), eV:	-8.8(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-1-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-methylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

CN(CC1=NN=C(O1)C2CC2)C3CCN(C3)CCC4=CC=CC=N4

DOS

IR

Vibrations