Geometry & MOs

Info

ID:	283799
PubChem CID:	104008484
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	294.117984
ΔH_f, kcal/mol:	-80.14
Dipole, Da:	4.62
IP(EA), eV:	-8.6(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(difluoromethoxy)benzoyl]-4-methylpiperidine-4-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C(=O)C2=C(C=CC(=C2)OC)OC)C#N

DOS

IR

Vibrations