Geometry & MOs

Info

ID:	146322
PubChem CID:	53670011
Reduced:	SN2C18H24 (1)
Stoich.:	AB2C18D24 (1)
Weight, g/mol:	312.16602
ΔH_f, kcal/mol:	39.35
Dipole, Da:	6.68
IP(EA), eV:	-8.4(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethane;3-(4-methylphenyl)-5-phenyl-1,2,4-thiadiazole

Drug info:

PubChemData

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CC(C)CCSC1=CC=C(C=C1)C=C(C)CN2C=CN=C2

DOS

IR

Vibrations