Geometry & MOs

Info

ID:	447528
PubChem CID:	135283606
Reduced:	FNOC12H13 (2)
Stoich.:	ABCD12E13 (2)
Weight, g/mol:	400.159849
ΔH_f, kcal/mol:	-144.68
Dipole, Da:	5.44
IP(EA), eV:	-8.99(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-3-fluoro-5-[3-fluoro-4-(morpholine-4-carbonyl)phenyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1F)C(=O)NC2CC2)C3=CC(=C(C=C3)NC(=O)C4CCCCC4)F

DOS

IR

Vibrations