Geometry & MOs

Info

ID:	362548
PubChem CID:	127308163
Reduced:	OF2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	318.149204
ΔH_f, kcal/mol:	-105.56
Dipole, Da:	3.05
IP(EA), eV:	-8.83(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluoro-4-methylphenyl)-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC2CN(CCN2C1)C(=O)NC3=C(C=CC=C3F)F

DOS

IR

Vibrations