Geometry & MOs

Info

ID:	130787
PubChem CID:	51107782
Reduced:	ON4C17H22 (1)
Stoich.:	AB4C17D22 (1)
Weight, g/mol:	339.118318
ΔH_f, kcal/mol:	11.23
Dipole, Da:	6.59
IP(EA), eV:	-9.84(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)NC(CN2C=NC=N2)C3=CC=CC=C3

DOS

IR

Vibrations