Geometry & MOs

Info

ID:	350871
PubChem CID:	127279159
Reduced:	O2F3N3C20H24 (1)
Stoich.:	A2B3C3D20E24 (1)
Weight, g/mol:	343.171834
ΔH_f, kcal/mol:	-202.0
Dipole, Da:	5.61
IP(EA), eV:	-9.38(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(2-cyclobutylpyrrolidin-1-yl)propanamide

Drug info:

PubChemData

Smile

C1CC(C1)C2CCCN2CC(=O)N3C(CC(=O)NC4=CC=CC=C43)C(F)(F)F

DOS

IR

Vibrations