Geometry & MOs

Info

ID:	402072
PubChem CID:	135054151
Reduced:	FN2O4C13H17 (1)
Stoich.:	AB2C4D13E17 (1)
Weight, g/mol:	395.246044
ΔH_f, kcal/mol:	-151.38
Dipole, Da:	3.43
IP(EA), eV:	-10.04(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-benzamido-3-(4-tert-butylphenyl)-2-methylpropanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC(C[N+](=O)[O-])C1=CC(=CC=C1)F

DOS

IR

Vibrations