Geometry & MOs

Info

ID:	390549
PubChem CID:	134999673
Reduced:	O4C19H26 (1)
Stoich.:	A4B19C26 (1)
Weight, g/mol:	289.204179
ΔH_f, kcal/mol:	-174.44
Dipole, Da:	1.92
IP(EA), eV:	-10.08(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (1S,2S)-2-[4-(diethylamino)phenyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@H]1C[C@H]1CCCCOC(=O)C2=CC=CC=C2

DOS

IR

Vibrations