Geometry & MOs

Info

ID:	281705
PubChem CID:	103914245
Reduced:	F2O2N3C13H17 (1)
Stoich.:	A2B2C3D13E17 (1)
Weight, g/mol:	267.138305
ΔH_f, kcal/mol:	-163.73
Dipole, Da:	5.03
IP(EA), eV:	-9.12(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(4-fluoroanilino)-2-oxoethyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCC(=O)NC1=C(C=CC=C1F)F

DOS

IR

Vibrations