Geometry & MOs

Info

ID:	343616
PubChem CID:	127266792
Reduced:	O2N4H14C15 (1)
Stoich.:	A2B4C14D15 (1)
Weight, g/mol:	371.104812
ΔH_f, kcal/mol:	32.43
Dipole, Da:	5.13
IP(EA), eV:	-8.87(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-fluoro-2-[[[4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]oxan-4-yl]amino]methyl]phenol

Drug info:

PubChemData

Smile

CC1=NN2C(=CC=NC2=C1)NC(=O)C3=C(OC=C3)C4CC4

DOS

IR

Vibrations