Geometry & MOs

Info

ID:	198015
PubChem CID:	79032151
Reduced:	ClNC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	236.200097
ΔH_f, kcal/mol:	-9.93
Dipole, Da:	0.74
IP(EA), eV:	-8.69(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-ethylpyrazol-4-yl)methyl]-1,2-dimethylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC1CC(CCN1C)NCC2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations