Geometry & MOs

Info

ID:	401869
PubChem CID:	135053131
Reduced:	ClNO3H12C16 (1)
Stoich.:	ABC3D12E16 (1)
Weight, g/mol:	413.199094
ΔH_f, kcal/mol:	-1.38
Dipole, Da:	5.21
IP(EA), eV:	-9.47(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(diethylamino)-7-ethoxy-6,8-diphenylchromen-4-one

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C2=C(CC3=CC=CC=C3O2)[N+](=O)[O-])Cl

DOS

IR

Vibrations