Geometry & MOs

Info

ID:	238406
PubChem CID:	92741048
Reduced:	N3O4C24H33 (1)
Stoich.:	A3B4C24D33 (1)
Weight, g/mol:	413.231456
ΔH_f, kcal/mol:	-142.96
Dipole, Da:	2.64
IP(EA), eV:	-8.74(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOCCCN1C(=O)C2=CC=C(N2C[C@@]1(C)C(=O)NC3CCCCC3)C4=CC=CO4

DOS

IR

Vibrations