Geometry & MOs

Info

ID:	175324
PubChem CID:	75882788
Reduced:	O4H18C19 (1)
Stoich.:	A4B18C19 (1)
Weight, g/mol:	401.191483
ΔH_f, kcal/mol:	-107.44
Dipole, Da:	6.47
IP(EA), eV:	-9.06(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-[2-fluoro-5-[[2-(2-methylpiperidin-1-yl)acetyl]amino]phenyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)C=CC2=CC=C(C=C2)OCCC(=O)O

DOS

IR

Vibrations