Geometry & MOs

Info

ID:	238502
PubChem CID:	92741579
Reduced:	N3O4H25C26 (1)
Stoich.:	A3B4C25D26 (1)
Weight, g/mol:	497.231456
ΔH_f, kcal/mol:	-47.95
Dipole, Da:	2.92
IP(EA), eV:	-8.72(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-benzyl-2-[2-(4-ethoxyphenyl)ethyl]-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)N1CCC3=CC=CO3)C4=CC=CO4)C(=O)NCC5=CC=CC=C5

DOS

IR

Vibrations