Geometry & MOs

Info

ID:	255250
PubChem CID:	103130910
Reduced:	SN3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	253.161269
ΔH_f, kcal/mol:	19.39
Dipole, Da:	0.82
IP(EA), eV:	-8.34(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfanyl-N-ethyl-1-(1-methylpyrazol-3-yl)ethanamine

Drug info:

PubChemData

Smile

CCC(C)SCC(C1=NN(C=C1)C)NC

DOS

IR

Vibrations