Geometry & MOs

Info

ID:	238418
PubChem CID:	92741076
Reduced:	O3N4C25H28 (1)
Stoich.:	A3B4C25D28 (1)
Weight, g/mol:	412.247441
ΔH_f, kcal/mol:	-55.35
Dipole, Da:	1.7
IP(EA), eV:	-8.73(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclohexyl-2-[2-(dimethylamino)ethyl]-6-(furan-2-yl)-3-methyl-1-oxo-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@]1(CN2C(=CC=C2C(=O)N1CC3=CC=CC=N3)C4=CC=CO4)C(=O)NC5CCCCC5

DOS

IR

Vibrations