Geometry & MOs

Info

ID:	265846
PubChem CID:	103554312
Reduced:	FNO4C16H22 (1)
Stoich.:	ABC4D16E22 (1)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-225.95
Dipole, Da:	3.7
IP(EA), eV:	-9.41(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(1-aminobut-3-enyl)morpholine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCOCC1C(C2=CC(=CC=C2)F)O

DOS

IR

Vibrations