Geometry & MOs

Info

ID:	347640
PubChem CID:	127272506
Reduced:	N3O4C21H25 (1)
Stoich.:	A3B4C21D25 (1)
Weight, g/mol:	367.153206
ΔH_f, kcal/mol:	-126.56
Dipole, Da:	6.15
IP(EA), eV:	-8.55(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-hydroxy-2,2-dimethyl-N-[4-(2-oxoimidazolidin-1-yl)phenyl]-3H-1-benzofuran-6-carboxamide

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=C(C=C2)C(=O)NCC3=CN=C(C=C3)N4CCOCC4)O)C

DOS

IR

Vibrations