Geometry & MOs

Info

ID:	279118
PubChem CID:	103841343
Reduced:	NF3O4C14H22 (1)
Stoich.:	AB3C4D14E22 (1)
Weight, g/mol:	363.128214
ΔH_f, kcal/mol:	-383.46
Dipole, Da:	3.04
IP(EA), eV:	-10.19(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(difluoromethyl)phenyl]-2-[ethyl(phenylmethoxycarbonyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(C1)(CCCC(F)(F)F)C(=O)O

DOS

IR

Vibrations