Geometry & MOs

Info

ID:	347648
PubChem CID:	127272514
Reduced:	N2O4C23H26 (1)
Stoich.:	A2B4C23D26 (1)
Weight, g/mol:	383.184506
ΔH_f, kcal/mol:	-141.06
Dipole, Da:	5.47
IP(EA), eV:	-8.69(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-2,2-dimethyl-N-[(2-morpholin-4-ylpyridin-3-yl)methyl]-3H-1-benzofuran-6-carboxamide

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=C(C=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)O)C

DOS

IR

Vibrations