Geometry & MOs

Info

ID:	177875
PubChem CID:	76247816
Reduced:	NO5C24H25 (1)
Stoich.:	AB5C24D25 (1)
Weight, g/mol:	362.163043
ΔH_f, kcal/mol:	-100.11
Dipole, Da:	1.85
IP(EA), eV:	-8.5(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoylamino]methyl]-N-methylbenzamide

Drug info:

PubChemData

Smile

CC(C1=CC2=C(O1)C(=CC=C2)OC)NC(=O)C=CC3=CC(=C(C=C3)OCC=C)OC

DOS

IR

Vibrations