Geometry & MOs

Info

ID:	418369
PubChem CID:	135104369
Reduced:	SO2N4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	370.236876
ΔH_f, kcal/mol:	24.57
Dipole, Da:	6.82
IP(EA), eV:	-9.19(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[4-[[3-(pyrrolidine-1-carbonyl)pyridin-2-yl]amino]piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCC1C(C2=CC=CS2)O)CC3=NN=C(O3)C4=CN=CC=C4

DOS

IR

Vibrations