Geometry & MOs

Info

ID:	37069
PubChem CID:	8016500
Reduced:	ClO2N4H21C22 (1)
Stoich.:	AB2C4D21E22 (1)
Weight, g/mol:	408.168522
ΔH_f, kcal/mol:	-24.85
Dipole, Da:	6.14
IP(EA), eV:	-8.63(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-ethyl-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-5-yl)oxy]-N-pyridin-3-ylacetamide

Drug info:

PubChemData

Smile

CCNC(=O)N1CCC2=C([C@]13C4=CC=CC=C4N(C3=O)C)NC5=C2C=C(C=C5)Cl

DOS

IR

Vibrations