Geometry & MOs

Info

ID:	171507
PubChem CID:	75384468
Reduced:	FON2C8H9 (2)
Stoich.:	ABC2D8E9 (2)
Weight, g/mol:	331.168462
ΔH_f, kcal/mol:	-117.68
Dipole, Da:	8.17
IP(EA), eV:	-9.28(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[4-[(3-pyridin-3-ylphenyl)methylamino]phenyl]acetamide

Drug info:

PubChemData

Smile

COC(=O)N1CCC(C1)NCC2=C(NN=C2)C3=C(C=CC=C3F)F

DOS

IR

Vibrations