Geometry & MOs

Info

ID:	302879
PubChem CID:	124398000
Reduced:	O2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	221.177964
ΔH_f, kcal/mol:	-165.18
Dipole, Da:	2.96
IP(EA), eV:	-9.56(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-diethyl-N-[(2S)-1-methoxypropan-2-yl]aniline

Drug info:

PubChemData

Smile

COC(=O)[C@H]1CCC2=C(C1)C=CC(=C2)C(=O)OC

DOS

IR

Vibrations