Geometry & MOs

Info

ID:	335163
PubChem CID:	127254024
Reduced:	N3O3C23H33 (1)
Stoich.:	A3B3C23D33 (1)
Weight, g/mol:	562.210387
ΔH_f, kcal/mol:	-109.85
Dipole, Da:	6.81
IP(EA), eV:	-8.66(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-2-[2-(4-methoxyphenyl)-5-methyl-7-oxofuro[3,2-b]pyran-3-yl]acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)NC(=O)N(C[C@@H]2CCCN3[C@@H]2CCCC3)CC4CC4

DOS

IR

Vibrations