Geometry & MOs

Info

ID:	143315
PubChem CID:	53186581
Reduced:	O2N4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	404.148455
ΔH_f, kcal/mol:	-29.83
Dipole, Da:	4.94
IP(EA), eV:	-8.99(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(5-benzyl-4-oxopyrazolo[1,5-a]quinoxaline-7-carbonyl)amino]acetate

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C)N4C(=CC=N4)C1=O

DOS

IR

Vibrations