Geometry & MOs

Info

ID:	330697
PubChem CID:	127248104
Reduced:	ON2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	316.189926
ΔH_f, kcal/mol:	-78.91
Dipole, Da:	8.11
IP(EA), eV:	-9.09(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1-acetylpyrrolidin-3-yl)methyl]-N-cyclopentylpyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC(C1)CC2=NC=CN=C2C(=O)NC3CCCCC3

DOS

IR

Vibrations