Geometry & MOs

Info

ID:	343871
PubChem CID:	127267047
Reduced:	SN3O3C17H23 (1)
Stoich.:	AB3C3D17E23 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	-73.06
Dipole, Da:	7.49
IP(EA), eV:	-8.36(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[(1-ethylpyrazol-4-yl)methylamino]-1-benzofuran-2-yl]methanol

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)CNC2=C(C=CC(=C2)S(=O)(=O)N)N(C)C

DOS

IR

Vibrations