Geometry & MOs

Info

ID:	248194
PubChem CID:	103079596
Reduced:	OSN6C9H14 (1)
Stoich.:	ABC6D9E14 (1)
Weight, g/mol:	211.114319
ΔH_f, kcal/mol:	30.81
Dipole, Da:	4.56
IP(EA), eV:	-8.61(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(cyclopentylmethylsulfanyl)-1-methylpyrazol-4-amine

Drug info:

PubChemData

Smile

CCCN1C(=O)NN=C1SC2=NN(C=C2N)C

DOS

IR

Vibrations