Geometry & MOs

Info

ID:	426136
PubChem CID:	135141054
Reduced:	N2F3O3C18H25 (1)
Stoich.:	A2B3C3D18E25 (1)
Weight, g/mol:	429.260312
ΔH_f, kcal/mol:	-286.88
Dipole, Da:	5.29
IP(EA), eV:	-9.8(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[3-(2-methylpropylamino)propyl]oxan-4-yl]methyl]-N-[6-(trifluoromethyl)pyridin-2-yl]propanamide

Drug info:

PubChemData

Smile

CCC(=O)N(CC1(CCOCC1)CCCO)C2=CC=CC(=N2)C(F)(F)F

DOS

IR

Vibrations