Geometry & MOs

Info

ID:	440426
PubChem CID:	135230403
Reduced:	FO4N9C32H38 (1)
Stoich.:	AB4C9D32E38 (1)
Weight, g/mol:	284.043105
ΔH_f, kcal/mol:	-42.95
Dipole, Da:	11.53
IP(EA), eV:	-8.68(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoro-N-(4-methyl-1,3-thiazol-2-yl)-2-phenoxyacetamide

Drug info:

PubChemData

Smile

CC1=C(N(N=C1C2=CN=C(N=C2)OC3CCN(CC3)C)C4=CC=CC=C4)NC(=O)N[C@@H]5CN(O[C@H]5C6=CC(=NC=C6)F)CCOC

DOS

IR

Vibrations