Geometry & MOs

Info

ID:	440274
PubChem CID:	135230206
Reduced:	N3C15H31 (1)
Stoich.:	A3B15C31 (1)
Weight, g/mol:	518.28454
ΔH_f, kcal/mol:	-37.12
Dipole, Da:	2.77
IP(EA), eV:	-8.71(2.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[4-[3-[(4-iodocyclohexyl)amino]propyl]cyclohexyl]-methylamino]ethyl]-N-methylpiperidin-4-amine

Drug info:

PubChemData

Smile

CCC1CCC(CC1)NCCN2CCC(CC2)N

DOS

IR

Vibrations