Geometry & MOs

Info

ID:	348420
PubChem CID:	127273521
Reduced:	N2O5C17H22 (1)
Stoich.:	A2B5C17D22 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-185.6
Dipole, Da:	2.8
IP(EA), eV:	-9.57(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dioxan-2-ylmethyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1COC(CO1)CNC(=O)[C@H]2COCC(=O)N2CC3=CC=CC=C3

DOS

IR

Vibrations