Geometry & MOs

Info

ID:	342890
PubChem CID:	127266053
Reduced:	ON2C15H20 (1)
Stoich.:	AB2C15D20 (1)
Weight, g/mol:	297.184112
ΔH_f, kcal/mol:	-12.46
Dipole, Da:	4.9
IP(EA), eV:	-8.85(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(3-methylimidazol-4-yl)ethyl]piperidin-4-yl]-phenylmethanone

Drug info:

PubChemData

Smile

C1CN(CC1C(=O)N)C[C@@H]2C[C@H]2C3=CC=CC=C3

DOS

IR

Vibrations