Geometry & MOs

Info

ID:	347645
PubChem CID:	127272511
Reduced:	O3N4C22H28 (1)
Stoich.:	A3B4C22D28 (1)
Weight, g/mol:	369.168856
ΔH_f, kcal/mol:	-84.59
Dipole, Da:	6.03
IP(EA), eV:	-8.32(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-2,2-dimethyl-N-(5-morpholin-4-ylpyridin-2-yl)-3H-1-benzofuran-6-carboxamide

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=C(C=C2)C(=O)NCC3=CN=C(C=C3)N4CCN(CC4)C)O)C

DOS

IR

Vibrations