Geometry & MOs

Info

ID:	336000
PubChem CID:	127255007
Reduced:	O4N6C15H16 (1)
Stoich.:	A4B6C15D16 (1)
Weight, g/mol:	370.175339
ΔH_f, kcal/mol:	-43.43
Dipole, Da:	10.55
IP(EA), eV:	-8.54(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-methyl-10-[2-[(2-methyl-1,2,4-triazol-3-yl)amino]ethyl]-11-oxo-8-oxa-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene-12-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=NN1)C(=O)NN2C=C3C(=NNC3=O)C(=C2)C(=O)OC

DOS

IR

Vibrations