Geometry & MOs

Info

ID:	85800
PubChem CID:	49879317
Reduced:	S2O3N6C16H18 (1)
Stoich.:	A2B3C6D16E18 (1)
Weight, g/mol:	366.169191
ΔH_f, kcal/mol:	-1.46
Dipole, Da:	5.36
IP(EA), eV:	-9.47(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-ethyl-3-oxopyrido[2,3-b]pyrazin-2-yl)-N-(3-methoxypropyl)benzamide

Drug info:

PubChemData

Smile

CCC1=NN=C(S1)NC(=O)C2=NN=C(S2)CCCC(=O)NCC3=CC=CO3

DOS

IR

Vibrations