Geometry & MOs

Info

ID:	342990
PubChem CID:	127266153
Reduced:	NO3F4H11C13 (1)
Stoich.:	AB3C4D11E13 (1)
Weight, g/mol:	322.189257
ΔH_f, kcal/mol:	-293.94
Dipole, Da:	5.31
IP(EA), eV:	-9.77(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(butan-2-ylamino)-1-(2-hydroxyphenyl)-2-oxoethyl]carbamate

Drug info:

PubChemData

Smile

C1CN(CC(=C1)F)C(=O)C2=C(C(=CC=C2)O)OC(F)(F)F

DOS

IR

Vibrations