Geometry & MOs

Info

ID:	280809
PubChem CID:	103851368
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	284.200097
ΔH_f, kcal/mol:	-7.57
Dipole, Da:	3.57
IP(EA), eV:	-9.18(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,3-dimethylpyrazol-4-yl)methyl]-1-phenylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCC1)NCC2=CC=CC=C2C#N

DOS

IR

Vibrations