Geometry & MOs

Info

ID:	285526
PubChem CID:	104110020
Reduced:	ClNC10H20 (1)
Stoich.:	ABC10D20 (1)
Weight, g/mol:	257.165876
ΔH_f, kcal/mol:	-39.99
Dipole, Da:	3.88
IP(EA), eV:	-9.15(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[(2,5-diethylpyrazol-3-yl)methyl]pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCC1CCC1

DOS

IR

Vibrations