Geometry & MOs

Info

ID:	255572
PubChem CID:	103133089
Reduced:	BrNO2C17H26 (1)
Stoich.:	ABC2D17E26 (1)
Weight, g/mol:	277.204179
ΔH_f, kcal/mol:	-87.38
Dipole, Da:	2.6
IP(EA), eV:	-9.05(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[[2-[(5-methyloxolan-2-yl)methoxy]phenyl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)COC2=C(C=C(C=C2)CNCC(C)C)Br

DOS

IR

Vibrations