Geometry & MOs

Info

ID:	293804
PubChem CID:	117402697
Reduced:	SN3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	259.114319
ΔH_f, kcal/mol:	53.4
Dipole, Da:	2.22
IP(EA), eV:	-8.59(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-cyclobutylsulfanylphenyl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

C1CSCCC1C2=CC=C(C=C2)C3=CC(=NN3)N

DOS

IR

Vibrations