Geometry & MOs

Info

ID:	237614
PubChem CID:	92720022
Reduced:	FSN2O4C27H27 (1)
Stoich.:	ABC2D4E27F27 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-130.87
Dipole, Da:	4.79
IP(EA), eV:	-8.78(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2-(2-methoxyethyl)-N-(4-methylcyclohexyl)-3-oxo-1,4-dihydropyrrolo[1,2-a]pyrazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)OCCCNC(=O)C1=CC2=C(C=C1)[S@](=O)C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4F

DOS

IR

Vibrations