Geometry & MOs

Info

ID:	249167
PubChem CID:	103087366
Reduced:	SN3C8H15 (1)
Stoich.:	AB3C8D15 (1)
Weight, g/mol:	213.129969
ΔH_f, kcal/mol:	32.58
Dipole, Da:	3.98
IP(EA), eV:	-8.34(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-N-(4-methylsulfanylbutyl)pyrazol-4-amine

Drug info:

PubChemData

Smile

CSCCCCNC1=CNN=C1

DOS

IR

Vibrations