Geometry & MOs

Info

ID:	351061
PubChem CID:	127279498
Reduced:	O2F3N4C18H19 (1)
Stoich.:	A2B3C4D18E19 (1)
Weight, g/mol:	387.198048
ΔH_f, kcal/mol:	-147.91
Dipole, Da:	7.74
IP(EA), eV:	-9.0(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-N-[2-methyl-5-(thiomorpholine-4-carbonyl)phenyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C2CCCN2C(=O)NC3=CC=C(C=C3)C4=NOC(=N4)C(F)(F)F

DOS

IR

Vibrations