Geometry & MOs

Info

ID:	78477
PubChem CID:	49693205
Reduced:	FNOC10H10 (2)
Stoich.:	ABCD10E10 (2)
Weight, g/mol:	368.190006
ΔH_f, kcal/mol:	-139.4
Dipole, Da:	4.69
IP(EA), eV:	-9.32(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-fluorobenzoyl)piperidin-4-yl]methyl]-3,4-dimethylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCC1CNC(=O)C2=CC=C(C=C2)F)C(=O)C3=CC=CC=C3F

DOS

IR

Vibrations