Geometry & MOs

Info

ID:	354228
PubChem CID:	127286192
Reduced:	FSO3N4C18H25 (1)
Stoich.:	ABC3D4E18F25 (1)
Weight, g/mol:	390.186732
ΔH_f, kcal/mol:	-150.23
Dipole, Da:	7.43
IP(EA), eV:	-8.52(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[8-(difluoromethoxy)quinolin-5-yl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)NC3=C(C=CC(=C3)N4CCCS4(=O)=O)F

DOS

IR

Vibrations