Geometry & MOs

Info

ID:	174506
PubChem CID:	75775369
Reduced:	FO3N6C27H39 (1)
Stoich.:	AB3C6D27E39 (1)
Weight, g/mol:	370.180504
ΔH_f, kcal/mol:	-114.89
Dipole, Da:	5.06
IP(EA), eV:	-8.56(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-2-fluorophenyl]piperidin-3-yl]-(2-methylaziridin-1-yl)methanone

Drug info:

PubChemData

Smile

CCCCNC(=O)CN1CCN(CC1)C(=O)C2CCCN(C2)C3=C(C=C(C=C3)C4=NOC(=N4)CCC)F

DOS

IR

Vibrations