Geometry & MOs

Info

ID:	281217
PubChem CID:	103911515
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	217.167794
ΔH_f, kcal/mol:	-69.33
Dipole, Da:	1.39
IP(EA), eV:	-8.93(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-4-[(2-methyloxan-4-yl)amino]butan-2-ol

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(C2CC2)NCCC(COC)O

DOS

IR

Vibrations