Geometry & MOs

Info

ID:	31986
PubChem CID:	3727037
Reduced:	NO6C27H31 (1)
Stoich.:	AB6C27D31 (1)
Weight, g/mol:	379.141973
ΔH_f, kcal/mol:	-226.94
Dipole, Da:	5.11
IP(EA), eV:	-9.65(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxolan-2-ylmethyl)-2-(2-oxo-4-phenylchromen-7-yl)oxyacetamide

Drug info:

PubChemData

Smile

CCCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C(C(C)C)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations