Geometry & MOs

Info

ID:	256051
PubChem CID:	103136635
Reduced:	BrNO2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	278.199428
ΔH_f, kcal/mol:	-89.85
Dipole, Da:	4.14
IP(EA), eV:	-8.81(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-methyl-3-[(5-methyloxolan-2-yl)methoxy]pyridin-2-yl]butan-2-amine

Drug info:

PubChemData

Smile

CCC(CC1=CC(=C(C=C1)OCC2CCC(O2)C)Br)N

DOS

IR

Vibrations