Geometry & MOs

Info

ID:	343268
PubChem CID:	127266441
Reduced:	ON3C22H25 (1)
Stoich.:	AB3C22D25 (1)
Weight, g/mol:	340.179835
ΔH_f, kcal/mol:	-1.81
Dipole, Da:	4.28
IP(EA), eV:	-8.54(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-(4-ethoxybutanoylamino)-4-fluorophenyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1NC(=O)N2CCC3=C(C2)C4=CC=CC=C4N3

DOS

IR

Vibrations