Geometry & MOs

Info

ID:	195254
PubChem CID:	78665716
Reduced:	NF4O4H17C20 (1)
Stoich.:	AB4C4D17E20 (1)
Weight, g/mol:	394.273262
ΔH_f, kcal/mol:	-319.71
Dipole, Da:	3.26
IP(EA), eV:	-8.95(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

N-(1-benzylpyrrolidin-1-ium-3-yl)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]acetamide

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2C1NC(=O)C=CC3=C(C=C(C=C3)OC(F)F)OC(F)F

DOS

IR

Vibrations