Geometry & MOs

Info

ID:	198160
PubChem CID:	79059303
Reduced:	SN2C18H26 (1)
Stoich.:	AB2C18D26 (1)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	17.97
Dipole, Da:	1.64
IP(EA), eV:	-8.1(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-ethylpyrazol-4-yl)-1-(1-piperidin-1-ylcyclopentyl)ethanamine

Drug info:

PubChemData

Smile

CCC(C)(C(CC1=CSC2=CC=CC=C21)N)N3CCCC3

DOS

IR

Vibrations