Geometry & MOs

Info

ID:	238479
PubChem CID:	92741399
Reduced:	N3O4C23H27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	399.252192
ΔH_f, kcal/mol:	-95.32
Dipole, Da:	3.35
IP(EA), eV:	-8.84(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)[C@]1(CN2C(=CC=C2C(=O)N1CC3=CC=CO3)C4=CC=CO4)C

DOS

IR

Vibrations