Geometry & MOs

Info

ID:	244176
PubChem CID:	99319198
Reduced:	SF2N2O2H22C24 (1)
Stoich.:	AB2C2D2E22F24 (1)
Weight, g/mol:	407.057375
ΔH_f, kcal/mol:	-110.28
Dipole, Da:	1.63
IP(EA), eV:	-9.14(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2,4-difluorobenzoyl)amino]ethyl]-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(C2=CC=CC=C2)SCC(=O)NCCNC(=O)C3=C(C=C(C=C3)F)F

DOS

IR

Vibrations