Geometry & MOs

Info

ID:	221883
PubChem CID:	85291984
Reduced:	NO3C19H27 (1)
Stoich.:	AB3C19D27 (1)
Weight, g/mol:	319.157229
ΔH_f, kcal/mol:	-104.01
Dipole, Da:	3.16
IP(EA), eV:	-8.83(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(3-phenylprop-2-enyl)-1-benzofuran-2-yl]methyl]propanamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N(CC1=CC=C(C=C1)OC)C(CC=C)C=C

DOS

IR

Vibrations