Geometry & MOs

Info

ID:	426730
PubChem CID:	135153603
Reduced:	NO4C18H21 (1)
Stoich.:	AB4C18D21 (1)
Weight, g/mol:	301.049668
ΔH_f, kcal/mol:	-112.1
Dipole, Da:	5.29
IP(EA), eV:	-9.22(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethyl)-N-(5-fluoro-2-methylphenyl)-N-methylthiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

COCOCCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)C=O

DOS

IR

Vibrations