Geometry & MOs

Info

ID:	364242
PubChem CID:	127314546
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-83.85
Dipole, Da:	4.6
IP(EA), eV:	-9.73(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CN(CC2=NC=NC=C21)C(=O)CNC(=O)CC34CC5CC(C3)CC(C5)C4

DOS

IR

Vibrations