Geometry & MOs

Info

ID:	310250
PubChem CID:	126577319
Reduced:	S2F3N3O4C21H24 (1)
Stoich.:	A2B3C3D4E21F24 (1)
Weight, g/mol:	435.288577
ΔH_f, kcal/mol:	-306.84
Dipole, Da:	3.28
IP(EA), eV:	-9.34(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methylphenoxy)-N-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1C(=O)OC2CCOC2)NC(=O)NCC3=C(SC4=C3CCNC4)C(F)(F)F)C

DOS

IR

Vibrations