Geometry & MOs

Info

ID:	148573
PubChem CID:	53788241
Reduced:	C31H36 (1)
Stoich.:	A31B36 (1)
Weight, g/mol:	152.015667
ΔH_f, kcal/mol:	54.35
Dipole, Da:	0.51
IP(EA), eV:	-8.83(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1H-pyrazol-5-yl)thiadiazole

Drug info:

PubChemData

Smile

C1CCC2C(C1)CC3C2CCCC3C(C4=CC=CC4)(C5=CC=CC=C5)C6=CC=CC=C6

DOS

IR

Vibrations