Geometry & MOs

Info

ID:	238405
PubChem CID:	92741047
Reduced:	SN3O3C24H27 (1)
Stoich.:	AB3C3D24E27 (1)
Weight, g/mol:	427.247107
ΔH_f, kcal/mol:	-53.18
Dipole, Da:	5.8
IP(EA), eV:	-8.72(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclohexyl-2-(3-ethoxypropyl)-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=CS3)C4=CC=CO4)C(=O)NC5CCCCC5

DOS

IR

Vibrations