Geometry & MOs

Info

ID:	233719
PubChem CID:	92093055
Reduced:	O3N4H18C19 (1)
Stoich.:	A3B4C18D19 (1)
Weight, g/mol:	339.118318
ΔH_f, kcal/mol:	-42.95
Dipole, Da:	2.19
IP(EA), eV:	-9.51(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-difluorophenyl)-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CN1C=C(C(=CC1=O)OC)C(=O)NCC2=C(N=CC=C2)C3=CC=NC=C3

DOS

IR

Vibrations