Geometry & MOs

Info

ID:	145647
PubChem CID:	53563771
Reduced:	N3O3H15C19 (1)
Stoich.:	A3B3C15D19 (1)
Weight, g/mol:	314.166414
ΔH_f, kcal/mol:	-6.55
Dipole, Da:	2.46
IP(EA), eV:	-9.35(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(2-bicyclo[2.2.1]heptanylmethyl)pyrrolidin-1-yl]-2-oxoethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C(=O)O)OC1=CC=CC(=C1)/C=C(/C#N)\C2=NC3=CC=CC=C3N2

DOS

IR

Vibrations