Geometry & MOs

Info

ID:	7185
PubChem CID:	71489
Reduced:	BrON2C22H29 (1)
Stoich.:	ABC2D22E29 (1)
Weight, g/mol:	416.14633
ΔH_f, kcal/mol:	-17.78
Dipole, Da:	16.82
IP(EA), eV:	-7.54(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide;bromide

Drug info:

PubChemData

Smile

C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[Br-]

DOS

IR

Vibrations