Geometry & MOs

Info

ID:	199395
PubChem CID:	79241241
Reduced:	ClON4H9C13 (1)
Stoich.:	ABC4D9E13 (1)
Weight, g/mol:	239.118925
ΔH_f, kcal/mol:	58.88
Dipole, Da:	4.99
IP(EA), eV:	-9.87(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(6-chloropyridin-2-yl)methyl]piperidin-2-yl]methanamine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(N=N2)CC3=NC(=CC=C3)Cl

DOS

IR

Vibrations