Geometry & MOs

Info

ID:	59237
PubChem CID:	24775808
Reduced:	F2O2N3H15C22 (1)
Stoich.:	A2B2C3D15E22 (1)
Weight, g/mol:	391.113233
ΔH_f, kcal/mol:	-35.99
Dipole, Da:	5.77
IP(EA), eV:	-9.02(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-[5-[2-methyl-5-(1,2-oxazol-5-yl)phenyl]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=CC=NO2)C3=NC=C(C=C3)NC(=O)C4=C(C=CC=C4F)F

DOS

IR

Vibrations