Geometry & MOs

Info

ID:	121367
PubChem CID:	50765348
Reduced:	O2N3C21H23 (1)
Stoich.:	A2B3C21D23 (1)
Weight, g/mol:	355.108754
ΔH_f, kcal/mol:	-25.33
Dipole, Da:	1.45
IP(EA), eV:	-8.31(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 3-(3-chloroanilino)quinoxaline-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC2=NC3=CC=CC=C3N=C2C(=O)OCC(C)C)C

DOS

IR

Vibrations