Geometry & MOs

Info

ID:	238412
PubChem CID:	92741064
Reduced:	SN3O3C25H29 (1)
Stoich.:	AB3C3D25E29 (1)
Weight, g/mol:	451.192963
ΔH_f, kcal/mol:	-64.66
Dipole, Da:	1.46
IP(EA), eV:	-8.82(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@]1(CN2C(=CC=C2C(=O)N1CCC3=CC=CS3)C4=CC=CO4)C(=O)NC5CCCCC5

DOS

IR

Vibrations