Geometry & MOs

Info

ID:	59192
PubChem CID:	24775711
Reduced:	ClOSN4H15C21 (1)
Stoich.:	ABCD4E15F21 (1)
Weight, g/mol:	427.035767
ΔH_f, kcal/mol:	71.21
Dipole, Da:	3.25
IP(EA), eV:	-9.22(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[2-chloro-5-(1,3-thiazol-2-yl)phenyl]pyridin-3-yl]-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CN=C1)C(=O)NC2=NC=C(C=C2)C3=C(C=CC(=C3)C4=NC=CS4)Cl

DOS

IR

Vibrations