Geometry & MOs

Info

ID:	208613
PubChem CID:	80551969
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	250.179361
ΔH_f, kcal/mol:	-32.45
Dipole, Da:	4.8
IP(EA), eV:	-9.3(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(ethylaminomethyl)piperidin-1-yl]-(2-methylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC(C(C1=CC=CC=C1)N)C(=O)NCC2CCC2

DOS

IR

Vibrations