Geometry & MOs

Info

ID:	336258
PubChem CID:	127255265
Reduced:	N2O4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	418.200491
ΔH_f, kcal/mol:	-129.47
Dipole, Da:	9.33
IP(EA), eV:	-8.49(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=O)C(=CN1)OCC(=O)NC(C2=CC=C(C=C2)OC)C(C)C

DOS

IR

Vibrations