Geometry & MOs

Info

ID:	422705
PubChem CID:	135118276
Reduced:	O2N5C18H25 (1)
Stoich.:	A2B5C18D25 (1)
Weight, g/mol:	286.156039
ΔH_f, kcal/mol:	-12.35
Dipole, Da:	4.36
IP(EA), eV:	-9.03(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chloropyrazol-1-yl)ethyl]-N-methyl-2-morpholin-4-ylpropan-1-amine

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)CN2CCCN(CC2)C(=O)C3=CN=C(C=C3)OC

DOS

IR

Vibrations