Geometry & MOs

Info

ID:	287796
PubChem CID:	104294637
Reduced:	NF2O3C14H15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	299.096914
ΔH_f, kcal/mol:	-213.83
Dipole, Da:	4.74
IP(EA), eV:	-10.11(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2,4-difluoro-5-methylbenzoyl)morpholin-3-yl]acetic acid

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)F)C(=O)N2CCCC[C@@H]2C(=O)O

DOS

IR

Vibrations