Geometry & MOs

Info

ID:	222578
PubChem CID:	85305558
Reduced:	NSiO4C19H39 (1)
Stoich.:	ABC4D19E39 (1)
Weight, g/mol:	373.0717
ΔH_f, kcal/mol:	-300.45
Dipole, Da:	3.54
IP(EA), eV:	-9.01(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-2-(2-methoxyphenyl)-3-nitro-8-prop-2-enyl-2H-chromen-4-one

Drug info:

PubChemData

Smile

CCCC1(CC(CN1C(=O)OC(C)(C)C)O[Si](C)(C)C(C)(C)C)CO

DOS

IR

Vibrations