Geometry & MOs

Info

ID:	244171
PubChem CID:	99319179
Reduced:	ClF2N2O2H15C18 (1)
Stoich.:	AB2C2D2E15F18 (1)
Weight, g/mol:	372.092163
ΔH_f, kcal/mol:	-126.27
Dipole, Da:	0.97
IP(EA), eV:	-9.67(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2,4-difluorobenzoyl)amino]ethyl]-4-oxochromene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)/C=C/C(=O)NCCNC(=O)C2=C(C=C(C=C2)F)F

DOS

IR

Vibrations