Geometry & MOs

Info

ID:	358341
PubChem CID:	127295886
Reduced:	N3O3C17H21 (1)
Stoich.:	A3B3C17D21 (1)
Weight, g/mol:	319.178358
ΔH_f, kcal/mol:	-99.0
Dipole, Da:	6.41
IP(EA), eV:	-9.13(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-N,2,2-trimethyl-N-(oxan-3-ylmethyl)-3H-1-benzofuran-6-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2)C(=O)N(C)CC3CCCOC3

DOS

IR

Vibrations