Geometry & MOs

Info

ID:	238476
PubChem CID:	92741390
Reduced:	O3N5C27H39 (1)
Stoich.:	A3B5C27D39 (1)
Weight, g/mol:	419.220892
ΔH_f, kcal/mol:	-86.77
Dipole, Da:	4.94
IP(EA), eV:	-8.32(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2-benzyl-6-(furan-2-yl)-3-methyl-N-(3-methylbutyl)-1-oxo-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@]1(CN2C(=CC=C2C(=O)N1CCN3CCN(CC3)C)C4=CC=CO4)C(=O)NC5CCCCCC5

DOS

IR

Vibrations