Geometry & MOs

Info

ID:	304490
PubChem CID:	124754292
Reduced:	O3N4H20C22 (1)
Stoich.:	A3B4C20D22 (1)
Weight, g/mol:	388.153541
ΔH_f, kcal/mol:	-39.6
Dipole, Da:	3.07
IP(EA), eV:	-8.99(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-[(2R)-2,3-dihydro-1-benzofuran-2-carbonyl]-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CN(CC2=C1N=C(N2)C3=CC=C(C=C3)C(=O)N)C(=O)[C@@H]4CC5=CC=CC=C5O4

DOS

IR

Vibrations