Geometry & MOs

Info

ID:	120773
PubChem CID:	50744025
Reduced:	S2O4N7H13C15 (1)
Stoich.:	A2B4C7D13E15 (1)
Weight, g/mol:	429.168856
ΔH_f, kcal/mol:	-11.54
Dipole, Da:	3.22
IP(EA), eV:	-9.28(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 3-[(2,5-dimethoxyphenyl)methylamino]quinoxaline-2-carboxylate

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C(=O)N2C)C)N=C1SC3=NN=C(S3)NC(=O)C4=CC=CO4

DOS

IR

Vibrations