Geometry & MOs

Info

ID:	238446
PubChem CID:	92741228
Reduced:	N3O3C23H31 (1)
Stoich.:	A3B3C23D31 (1)
Weight, g/mol:	431.220892
ΔH_f, kcal/mol:	-103.01
Dipole, Da:	6.78
IP(EA), eV:	-8.67(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-cyclopentyl-2-(3,5-dimethylphenyl)-6-(furan-2-yl)-3-methyl-1-oxo-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CCN1C(=O)C2=CC=C(N2C[C@]1(C)C(=O)NC3CCCC3)C4=CC=CO4

DOS

IR

Vibrations