Geometry & MOs

Info

ID:	238500
PubChem CID:	92741548
Reduced:	N3O7C26H29 (1)
Stoich.:	A3B7C26D29 (1)
Weight, g/mol:	421.200156
ΔH_f, kcal/mol:	-216.56
Dipole, Da:	2.76
IP(EA), eV:	-8.42(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(=O)CNC(=O)[C@@]1(CN2C(=CC=C2C(=O)N1CC3=C(C=CC(=C3)OC)OC)C4=CC=CO4)C

DOS

IR

Vibrations