Geometry & MOs

Info

ID:	375830
PubChem CID:	134221821
Reduced:	FNO4C30H32 (1)
Stoich.:	ABC4D30E32 (1)
Weight, g/mol:	474.272987
ΔH_f, kcal/mol:	-195.07
Dipole, Da:	6.95
IP(EA), eV:	-8.7(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[[7-(diethylamino)-2-oxochromene-3-carbonyl]amino]-3-methylpentan-3-yl]oxy-2,2-dimethylbutanoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=C(C(=CC3=C2CCN3C(=O)C4=C(C=C(C=C4)F)C)C)[C@@H](C(=O)O)OC(C)(C)C

DOS

IR

Vibrations