Geometry & MOs

Info

ID:	369719
PubChem CID:	127335149
Reduced:	O3N4C17H26 (1)
Stoich.:	A3B4C17D26 (1)
Weight, g/mol:	303.169525
ΔH_f, kcal/mol:	-97.48
Dipole, Da:	3.73
IP(EA), eV:	-8.57(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)COCC3CCOC3

DOS

IR

Vibrations