Geometry & MOs

Info

ID:	285527
PubChem CID:	104110021
Reduced:	ClN3C13H24 (1)
Stoich.:	AB3C13D24 (1)
Weight, g/mol:	262.181191
ΔH_f, kcal/mol:	-17.91
Dipole, Da:	3.43
IP(EA), eV:	-9.27(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(4-propan-2-ylmorpholin-2-yl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CCC1=NN(C(=C1)CNC(C)CC(C)Cl)CC

DOS

IR

Vibrations