Geometry & MOs

Info

ID:	205096
PubChem CID:	80054956
Reduced:	SN2O2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	236.13472
ΔH_f, kcal/mol:	-63.17
Dipole, Da:	6.5
IP(EA), eV:	-9.07(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-pyridin-4-ylsulfanylpropyl)cyclopentanamine

Drug info:

PubChemData

Smile

CC(C)NC(CSC1=CC=NC=C1)C(=O)O

DOS

IR

Vibrations