Geometry & MOs

Info

ID:	238503
PubChem CID:	92741581
Reduced:	N3O4C30H31 (1)
Stoich.:	A3B4C30D31 (1)
Weight, g/mol:	473.150619
ΔH_f, kcal/mol:	-66.84
Dipole, Da:	8.5
IP(EA), eV:	-8.42(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CCN2C(=O)C3=CC=C(N3C[C@@]2(C)C(=O)NCC4=CC=CC=C4)C5=CC=CO5

DOS

IR

Vibrations