Geometry & MOs

Info

ID:	57093
PubChem CID:	22395327
Reduced:	FN4O4H21C25 (1)
Stoich.:	AB4C4D21E25 (1)
Weight, g/mol:	334.179361
ΔH_f, kcal/mol:	-15.09
Dipole, Da:	12.09
IP(EA), eV:	-8.65(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-7-(dimethylamino)-4-[3-(dimethylamino)phenyl]-4H-chromene-3-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C1=CC2=C(C=C1)C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)[N+](=O)[O-]

DOS

IR

Vibrations