Geometry & MOs

Info

ID:	84072
PubChem CID:	49863996
Reduced:	FNO4H14C18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	377.087492
ΔH_f, kcal/mol:	-135.03
Dipole, Da:	5.57
IP(EA), eV:	-8.63(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-methoxy-4-oxo-2-[4-(trifluoromethyl)phenyl]chromen-6-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=C(C=C1)OC(=C(C2=O)OC)C3=CC=C(C=C3)F

DOS

IR

Vibrations