Geometry & MOs

Info

ID:	426743
PubChem CID:	135153667
Reduced:	FSO2N3C14H16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	413.84201
ΔH_f, kcal/mol:	-53.79
Dipole, Da:	4.88
IP(EA), eV:	-9.02(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dibromopyridin-2-yl)-4-(difluoromethyl)thiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)OC)C(=O)C2=C(N=NS2)CCF

DOS

IR

Vibrations