Geometry & MOs

Info

ID:	238419
PubChem CID:	92741086
Reduced:	O3N4C23H32 (1)
Stoich.:	A3B4C23D32 (1)
Weight, g/mol:	423.252192
ΔH_f, kcal/mol:	-90.09
Dipole, Da:	3.94
IP(EA), eV:	-8.59(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N,2-dicyclohexyl-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)N1CCN(C)C)C3=CC=CO3)C(=O)NC4CCCCC4

DOS

IR

Vibrations