Geometry & MOs

Info

ID:	130337
PubChem CID:	51075642
Reduced:	N2F3O3C11H13 (1)
Stoich.:	A2B3C3D11E13 (1)
Weight, g/mol:	283.132077
ΔH_f, kcal/mol:	-272.66
Dipole, Da:	1.47
IP(EA), eV:	-9.79(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(4-hydroxyphenyl)piperidin-1-yl]-pyrazin-2-ylmethanone

Drug info:

PubChemData

Smile

CC(COC)NC(=O)C1=CC=C(NC1=O)C(F)(F)F

DOS

IR

Vibrations