Geometry & MOs

Info

ID:	56842
PubChem CID:	22394347
Reduced:	SN2Cl3O3H9C17 (1)
Stoich.:	AB2C3D3E9F17 (1)
Weight, g/mol:	142.146999
ΔH_f, kcal/mol:	-11.31
Dipole, Da:	1.89
IP(EA), eV:	-9.05(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-propan-2-ylpiperidin-4-amine

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1Cl)C=C(N2CC3=NOC(=C3)C4=CC=C(S4)Cl)C(=O)O)Cl

DOS

IR

Vibrations