Geometry & MOs

Info

ID:	238454
PubChem CID:	92741246
Reduced:	FN3O3C25H26 (1)
Stoich.:	AB3C3D25E26 (1)
Weight, g/mol:	431.220892
ΔH_f, kcal/mol:	-102.41
Dipole, Da:	5.42
IP(EA), eV:	-8.78(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclopentyl-2-(3-ethylphenyl)-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=C(C=C3)F)C4=CC=CO4)C(=O)NC5CCCC5

DOS

IR

Vibrations