Geometry & MOs

Info

ID:	365099
PubChem CID:	127316841
Reduced:	ON5C13H21 (1)
Stoich.:	AB5C13D21 (1)
Weight, g/mol:	368.184841
ΔH_f, kcal/mol:	0.65
Dipole, Da:	6.7
IP(EA), eV:	-9.03(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C(C)N3C=NC=N3

DOS

IR

Vibrations