Geometry & MOs

Info

ID:	237845
PubChem CID:	92721943
Reduced:	O3N4C25H38 (1)
Stoich.:	A3B4C25D38 (1)
Weight, g/mol:	473.150619
ΔH_f, kcal/mol:	-106.19
Dipole, Da:	3.55
IP(EA), eV:	-8.62(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[(4-chlorophenyl)methyl]-6-(furan-2-yl)-3-methyl-2-(4-methylphenyl)-1-oxo-4H-pyrrolo[1,2-a]pyrazine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)CCCN1C(=O)C2=CC=C(N2C[C@@]1(C)C(=O)NCCC(C)C)C3=CC=CO3

DOS

IR

Vibrations