Geometry & MOs

Info

ID:	39534
PubChem CID:	8141209
Reduced:	F3N3O4H14C19 (1)
Stoich.:	A3B3C4D14E19 (1)
Weight, g/mol:	374.05367
ΔH_f, kcal/mol:	-243.65
Dipole, Da:	7.95
IP(EA), eV:	-9.15(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3,4-difluorophenyl)-5-methyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@H](C(=O)NCC(=O)NC1=C(C(=C(C=C1)F)F)F)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations