Geometry & MOs

Info

ID:	59364
PubChem CID:	24844201
Reduced:	SN5C13H15 (1)
Stoich.:	AB5C13D15 (1)
Weight, g/mol:	194.178299
ΔH_f, kcal/mol:	101.68
Dipole, Da:	2.74
IP(EA), eV:	-8.99(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-nonyl-1H-pyrazole

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)N=NC2=C(N(N=C2C)C(=S)N)C

DOS

IR

Vibrations