Geometry & MOs

Info

ID:	285495
PubChem CID:	104109900
Reduced:	ClNF2C7H14 (1)
Stoich.:	ABC2D7E14 (1)
Weight, g/mol:	215.118925
ΔH_f, kcal/mol:	-145.54
Dipole, Da:	3.35
IP(EA), eV:	-9.77(0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(2-pyrazol-1-ylethyl)pentan-2-amine

Drug info:

PubChemData

Smile

CC(CC(C)Cl)NCC(F)F

DOS

IR

Vibrations