Geometry & MOs

Info

ID:	357011
PubChem CID:	127293077
Reduced:	N3O3C21H29 (1)
Stoich.:	A3B3C21D29 (1)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-118.57
Dipole, Da:	1.92
IP(EA), eV:	-8.43(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-2-morpholin-4-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations