Geometry & MOs

Info

ID:	331224
PubChem CID:	127248631
Reduced:	O3N4C20H22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	319.189592
ΔH_f, kcal/mol:	-54.93
Dipole, Da:	3.35
IP(EA), eV:	-9.31(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2-methoxyacetyl)pyrrolidin-3-yl]-N-(2-methylpropyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1C2=C(C=CC=N2)C(=O)N3CCOCC3)C(=O)C4=CC=CC=N4

DOS

IR

Vibrations