Geometry & MOs

Info

ID:	171481
PubChem CID:	75383208
Reduced:	OF2N3C17H25 (1)
Stoich.:	AB2C3D17E25 (1)
Weight, g/mol:	340.11471
ΔH_f, kcal/mol:	-129.52
Dipole, Da:	2.33
IP(EA), eV:	-8.92(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-N-methyl-1-[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]methanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=CC(=C1)F)F)NC2CCN(CC2)CC(=O)N(C)C

DOS

IR

Vibrations